diff --git a/backend/src/main/kotlin/org/loculus/backend/api/SubmissionTypes.kt b/backend/src/main/kotlin/org/loculus/backend/api/SubmissionTypes.kt index b3cc15b2ae..6352e85723 100644 --- a/backend/src/main/kotlin/org/loculus/backend/api/SubmissionTypes.kt +++ b/backend/src/main/kotlin/org/loculus/backend/api/SubmissionTypes.kt @@ -167,6 +167,11 @@ data class ProcessedData( description = "The key is the gene name, the value is a list of amino acid insertions", ) val aminoAcidInsertions: Map>, + @Schema( + example = """{"segment1": "fastaHeader1", "segment2": "fastaHeader2"}""", + description = "The key is the segment name, the value is the fastaHeader of the original Data", + ) + val sequenceNameToFastaHeaderMap: Map = emptyMap(), @Schema( example = """{"raw_reads": [{"fileId": "s0m3-uUiDd", "name": "data.fastaq"}], "sequencing_logs": []}""", description = "The key is the file category name, the value is a list of files, with ID and name.", diff --git a/backend/src/main/kotlin/org/loculus/backend/service/submission/CompressionService.kt b/backend/src/main/kotlin/org/loculus/backend/service/submission/CompressionService.kt index 3a82303e67..9e612e4927 100644 --- a/backend/src/main/kotlin/org/loculus/backend/service/submission/CompressionService.kt +++ b/backend/src/main/kotlin/org/loculus/backend/service/submission/CompressionService.kt @@ -118,6 +118,7 @@ class CompressionService( } }, processedData.aminoAcidInsertions, + processedData.sequenceNameToFastaHeaderMap, processedData.files, ) @@ -144,6 +145,7 @@ class CompressionService( } }, processedData.aminoAcidInsertions, + processedData.sequenceNameToFastaHeaderMap, processedData.files, ) diff --git a/backend/src/main/kotlin/org/loculus/backend/service/submission/EmptyProcessedDataProvider.kt b/backend/src/main/kotlin/org/loculus/backend/service/submission/EmptyProcessedDataProvider.kt index 959093fe80..f715554f08 100644 --- a/backend/src/main/kotlin/org/loculus/backend/service/submission/EmptyProcessedDataProvider.kt +++ b/backend/src/main/kotlin/org/loculus/backend/service/submission/EmptyProcessedDataProvider.kt @@ -20,6 +20,7 @@ class EmptyProcessedDataProvider(private val backendConfig: BackendConfig) { alignedAminoAcidSequences = referenceGenome.genes.map { it.name }.associateWith { null }, nucleotideInsertions = referenceGenome.nucleotideSequences.map { it.name }.associateWith { emptyList() }, aminoAcidInsertions = referenceGenome.genes.map { it.name }.associateWith { emptyList() }, + sequenceNameToFastaHeaderMap = referenceGenome.nucleotideSequences.map { it.name }.associateWith { "" }, files = null, ) } diff --git a/backend/src/main/kotlin/org/loculus/backend/service/submission/ProcessedSequenceEntryValidator.kt b/backend/src/main/kotlin/org/loculus/backend/service/submission/ProcessedSequenceEntryValidator.kt index 61a69e10e5..4024d5f16d 100644 --- a/backend/src/main/kotlin/org/loculus/backend/service/submission/ProcessedSequenceEntryValidator.kt +++ b/backend/src/main/kotlin/org/loculus/backend/service/submission/ProcessedSequenceEntryValidator.kt @@ -232,6 +232,11 @@ class ProcessedSequenceEntryValidator(private val schema: Schema, private val re "alignedNucleotideSequences", ) + validateNoUnknownSegment( + processedData.sequenceNameToFastaHeaderMap, + "sequenceNameToFastaHeaderMap", + ) + validateNoUnknownSegment( processedData.unalignedNucleotideSequences, "unalignedNucleotideSequences", diff --git a/backend/src/main/kotlin/org/loculus/backend/service/submission/SubmissionDatabaseService.kt b/backend/src/main/kotlin/org/loculus/backend/service/submission/SubmissionDatabaseService.kt index fab9064311..5a6051c962 100644 --- a/backend/src/main/kotlin/org/loculus/backend/service/submission/SubmissionDatabaseService.kt +++ b/backend/src/main/kotlin/org/loculus/backend/service/submission/SubmissionDatabaseService.kt @@ -461,6 +461,7 @@ class SubmissionDatabaseService( aminoAcidInsertions = processedData.aminoAcidInsertions.mapValues { (_, it) -> it.map { insertion -> insertion.copy(sequence = insertion.sequence.uppercase(Locale.US)) } }, + sequenceNameToFastaHeaderMap = processedData.sequenceNameToFastaHeaderMap, ) private fun validateExternalMetadata( diff --git a/backend/src/test/kotlin/org/loculus/backend/controller/submission/PreparedProcessedData.kt b/backend/src/test/kotlin/org/loculus/backend/controller/submission/PreparedProcessedData.kt index 9a874a5ab5..d5523ac3af 100644 --- a/backend/src/test/kotlin/org/loculus/backend/controller/submission/PreparedProcessedData.kt +++ b/backend/src/test/kotlin/org/loculus/backend/controller/submission/PreparedProcessedData.kt @@ -62,6 +62,7 @@ val defaultProcessedData = ProcessedData( Insertion(123, "RN"), ), ), + sequenceNameToFastaHeaderMap = mapOf(MAIN_SEGMENT to "header"), files = null, ) @@ -101,6 +102,7 @@ val defaultProcessedDataMultiSegmented = ProcessedData( Insertion(123, "RN"), ), ), + sequenceNameToFastaHeaderMap = mapOf("notOnlySegment" to "header1", "secondSegment" to "header2"), files = null, ) @@ -117,6 +119,7 @@ val defaultProcessedDataWithoutSequences = ProcessedData( nucleotideInsertions = emptyMap(), alignedAminoAcidSequences = emptyMap(), aminoAcidInsertions = emptyMap(), + sequenceNameToFastaHeaderMap = emptyMap(), files = null, ) diff --git a/backend/src/test/kotlin/org/loculus/backend/service/ProcessedMetadataPostprocessorTest.kt b/backend/src/test/kotlin/org/loculus/backend/service/ProcessedMetadataPostprocessorTest.kt index 2a5d304275..6ecbb08e79 100644 --- a/backend/src/test/kotlin/org/loculus/backend/service/ProcessedMetadataPostprocessorTest.kt +++ b/backend/src/test/kotlin/org/loculus/backend/service/ProcessedMetadataPostprocessorTest.kt @@ -43,6 +43,7 @@ class ProcessedMetadataPostprocessorTest( nucleotideInsertions = emptyMap(), alignedAminoAcidSequences = emptyMap(), aminoAcidInsertions = emptyMap(), + sequenceNameToFastaHeaderMap = emptyMap(), files = null, ) diff --git a/backend/src/test/kotlin/org/loculus/backend/service/ProcessedSequencesPostprocessorTest.kt b/backend/src/test/kotlin/org/loculus/backend/service/ProcessedSequencesPostprocessorTest.kt index fcf7873912..51e6db7353 100644 --- a/backend/src/test/kotlin/org/loculus/backend/service/ProcessedSequencesPostprocessorTest.kt +++ b/backend/src/test/kotlin/org/loculus/backend/service/ProcessedSequencesPostprocessorTest.kt @@ -91,6 +91,10 @@ class ProcessedSequencesPostprocessorTest( unconfiguredPresentGene to listOf(Insertion(13, "TT")), unconfiguredNullGene to emptyList(), ), + sequenceNameToFastaHeaderMap = mapOf( + "configuredPresentSeg" to "header1", + "unconfiguredPresentSeg" to "header2", + ), files = null, ) diff --git a/backend/src/test/kotlin/org/loculus/backend/utils/EarliestReleaseDateFinderTest.kt b/backend/src/test/kotlin/org/loculus/backend/utils/EarliestReleaseDateFinderTest.kt index 03d4b781da..43e89af3a4 100644 --- a/backend/src/test/kotlin/org/loculus/backend/utils/EarliestReleaseDateFinderTest.kt +++ b/backend/src/test/kotlin/org/loculus/backend/utils/EarliestReleaseDateFinderTest.kt @@ -62,6 +62,7 @@ fun row( nucleotideInsertions = emptyMap(), alignedAminoAcidSequences = emptyMap(), aminoAcidInsertions = emptyMap(), + sequenceNameToFastaHeaderMap = emptyMap(), files = null, ), isRevocation = false, diff --git a/integration-tests/tests/fixtures/sequence.fixture.ts b/integration-tests/tests/fixtures/sequence.fixture.ts index 8b85bda877..cdde8d5770 100644 --- a/integration-tests/tests/fixtures/sequence.fixture.ts +++ b/integration-tests/tests/fixtures/sequence.fixture.ts @@ -23,16 +23,13 @@ export const test = groupTest.extend({ collectionDate: '2021-10-15', authorAffiliations: 'Test Institute, France', }); - const fastaHeaderL = `${submissionId}_L`; - const fastaHeaderM = `${submissionId}_M`; - const fastaHeaderS = `${submissionId}_S`; await submissionPage.fillSequenceData({ - [fastaHeaderL]: + fastaHeaderL: 'CCACATTGACACAGANAGCTCCAGTAGTGGTTCTCTGTCCTTATTAAACCATGGACTTCTTAAGAAACCTTGACTGGACTCAGGTGATTGCTAGTCAGTATGTGACCAATCCCAGGTTTAATATCTCTGATTACTTCGAGATTGTTCGACAGCCTGGTGACGGGAACTGTTTCTACCACAGTATAGCTGAGTTAACCATGCCCAACAAAACAGATCACTCATACCATAACATCAAACATCTGACTGAGGTGGCAGCACGGAAGTATTATCAGGAGGAGCCGGAGGCTAAGCTCATTGGCCTGAGTCTGGAAGACTATCTTAAGAGGATGCTATCTGACAACGAATGGGGATCGACTCTTGAGGCATCTATGTTGGCTAAGGAAATGGGTATTACTATCATCATTTGGACTGTTGCAGCCAGTGACGAAGTGGAAGCAGGCATAAAGTTTGGTGATGGTGATGTGTTTACAGCCGTGAATCTTCTGCACTCCGGACAGACACACTTTGATGCCCTCAGAATACTGCCNCANTTTGAGGCTGACACAAGAGAGNCCTTNAGTCTGGTAGACAANNTNATAGCTGTGGACCANNTGACCTCNTCTTCAAGTGATGAANTGCAGGACTANGAAGANCTTGCTTTAGCACTTACNAGNGCGGAAGAACCATNTAGACGGTCTAGCNTGGATGAGGTNACCCTNTCTAAGAAACAAGCAGAGNTATTGAGGCAGAAGGCATCTCAGTTGTCNAAACTGGTTAATAAAAGTCAGAACATACCGACTAGAGTTGGCAGGGTTCTGGACTGTATGTTTAACTGCAAACTATGTGTTGAAATATCAGCTGACACTCTAATTCTGCGACCAGAATCTAAAGAAAGAATTGG', - [fastaHeaderM]: + fastaHeaderM: 'GTGGATTGAGCATCTTAATTGCAGCATACTTGTCAACATCATGCATATATCATTGATGTATGCAGTTTTCTGCTTGCAGCTGTGCGGTCTAGGGAAAACTAACGGACTACACAATGGGACTGAACACAATAAGACACACGTTATGACAACGCCTGATGACAGTCAGAGCCCTGAACCGCCAGTGAGCACAGCCCTGCCTGTCACACCGGACCCTTCCACTGTCACACCTACAACACCAGCCAGCGGATTAGAAGGCTCAGGAGAGGTTCACACATCCTCTCCAATCACCACCAAGGGTTTGTCTCTGCCGGGGGCTACATCTGAGCTCCCTGCGACTACTAGCATAGTCACTTCAGGTGCAAGTGATGCCGATTCTAGCACACAGGCAGCCAGAGACACCCCTAAACCATCAGTCCGCACGAGTCTGCCCAACAGCCCTAGCACACCATCCACACCACAAGGCACACACCATCCCGTGAGGAGTCTGCTTTCAGTCACGAGCCCTAAGCCAGAAGAAACACCAACACCGTCAAAATCAAGCAAAGATAGCTCAGCAACCAACAGTCCTCACCCAGCCGCCAGCAGACCAACAACCCCTCCCACAACAGCCCAGAGACCCGCTGAAAACAACAGCCACAACACCACCGAACAGCTTGAGTCCTTAACACAATTAGCAACTTCAGGTTCAATGATCTCTCCAACACAGACAGTCCTCCCAAAGAGTGTTACTTCTATAGCCATTCAAGACATTCATCCCAGCCCAACAAATAGGTCTAAAAGAAACCTTGATATGGAAATAATCT', - [fastaHeaderS]: + fastaHeaderS: 'GTGTTCTCTTGAGTGTTGGCAAAATGGAAAACAAAATCGAGGTGAACAACAAAGATGAGATGAACAAATGGTTTGAGGAGTTCAAGAAAGGAAATGGACTTGTGGACACTTTCACAAACTCNTATTCCTTTTGTGAAAGCGTNCCAAATCTGGACAGNTTTGTNTTCCAGATGGCNAGTGCCACTGATGATGCACAAAANGANTCCATCTACGCATCTGCNCTGGTGGANGCAACCAAATTTTGTGCACCTATATACGAGTGTGCTTGGGCTAGCTCCACTGGCATTGTTAAAAAGGGACTGGAGTGGTTCGAGAAAAATGCAGGAACCATTAAATCCTGGGATGAGAGTTATACTGAGCTTAAAGTTGAAGTTCCCAAAATAGAACAACTCTCCAACTACCAGCAGGCTGCTCTCAAATGGAGAAAAGACATAGGCTTCCGTGTCAATGCAAATACGGCAGCTTTGAGTAACAAAGTCCTAGCAGAGTACAAAGTTCCTGGCGAGATTGTAATGTCTGTCAAAGAGATGTTGTCAGATATGATTAGAAGNAGGAACCTGATTCTCAACAGAGGTGGTGATGAGAACCCACGCGGCCCAGTTAGCCGTGAACATGTGGAGTGGTGC', }); diff --git a/integration-tests/tests/readonly.setup.ts b/integration-tests/tests/readonly.setup.ts index 6a7e6868df..fe7a88b84b 100644 --- a/integration-tests/tests/readonly.setup.ts +++ b/integration-tests/tests/readonly.setup.ts @@ -30,17 +30,16 @@ setup('Initialize a single ebola sequence as base data', async ({ page, baseURL } const submissionPage = new SingleSequenceSubmissionPage(page); - const submissionId = 'foobar-readonly'; const reviewPage = await submissionPage.completeSubmission( { - submissionId: submissionId, + submissionId: 'foobar-readonly', collectionCountry: 'France', collectionDate: '2021-05-12', authorAffiliations: 'Patho Institute, Paris', groupId: groupId.toString(), }, { - [submissionId]: + fastaHeader: 'nnnnnnnnnnnnnnnnnnnnnnnnnnnnnnnnnnn' + 'ATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAA' + 'TATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAG' + diff --git a/integration-tests/tests/specs/features/revise-sequence.spec.ts b/integration-tests/tests/specs/features/revise-sequence.spec.ts index 82b91df73f..18211fab74 100644 --- a/integration-tests/tests/specs/features/revise-sequence.spec.ts +++ b/integration-tests/tests/specs/features/revise-sequence.spec.ts @@ -27,12 +27,14 @@ test('revising sequence data works: segment can be deleted; segment can be edite await page.getByRole('link', { name: 'Revise this sequence' }).click({ timeout: 15000 }); await expect(page.getByRole('heading', { name: 'Create new revision from' })).toBeVisible(); - await page.getByTestId(/^discard.*_L_segment_file$/).click(); - await page.getByTestId(/^discard.*_S_segment_file$/).click(); + await page.getByTestId(/^discard.*L\)_segment_file$/).click(); + await page.getByTestId(/^discard.*S\)_segment_file$/).click(); + const newSsequence = + 'CAAATGGTTTGAGGAGTTCAAGAAAGGAAATGGACTTGTGGACACTTTCACAAACTCNTATTCCTTTTGTGAAAGCGTNCCAAATCTGGACAGNTTTGTNTTCCAGATGGCNAGTGCCACTGATGATGCACAAAANGANTCCATCTACGCATCTGCNCTGGTGGANGCAACCAAATTTTGTGCACCTATATACGAGTGTGCTTGGGCTAGCTCCACTGGCATTGTTAAAAAGGGACTGGAGTGGTTCGAGAAAAATGCAGGAACCATTAAATCCTGGGATGAGAGTTATACTGAGCTTAAAGTTGAAGTTCCCAAAATAGAACAACTCTCCAACTACCAGCAGGCTGCTCTCAAATGGAGAAAAGACATAGGCTTCCGTGTCAATGCAAATACGGCAGCTTTGAGTAACAAAGTCCTAGCAGAGTACAAAGTTCCTGGCGAGATTGTAATGTCTGTCAAAGAGATGTTGTCAGATATGATTAGAAGNAGGAACCTGATTCTCAACAGAGGTGGTGATGAGAACCCACGCGGCCCAGTTAGCCGTGAACATGTGGAGTGGTGCAGGGAATTCGTCAAAGGCAAGTACATAATGGCTTTCAACCCACCCTGGGGAGACATCAACAAGTCAGGCCGTTCAGGAATAGCACTTGTTGCAACAGGCCTTGCCAAGCTTGCAGAGACTGAAGGGAAGGGAGTTTTTGACGAAGCCAAGAAGACTATAGAGGCTCTTAACGGGTATCTGGACAAGCATAAGGATGAAGTTGACAAAGCAAGTGCCGACAGCATGATAACAAACCTCCTTAAGCACATTGCTAAGGCACAAGAGCTTTACAAAAACTCGTCTGCTCTTCGTGCTCAGGGTGCACAGATTGACACCGTCTTCAGCTCATACTACTGGCTCTACAAGGCCGGTGTGACTCCAGAGACCTTCCCGACTGTTTCACAGTTCCTTTTTGAGTTAGGGAAGCAACCAAGGGGCACCAAGAAAATGAAGAAGGCACTCCTGAGCACCCCAATGAAGTGGGGAAAGAAGCTTTATGAGCTTTTTGCTGATGATTCCTTCCAACAGAACAGGATCTACATGCACCCCGCTGTGCTAACAGCTGGCAGAATCAGTGAAATGGGTGTCTGCTTCGGAACAATCCCTGTGGCCAATCCTGATGATGCCGCCTTAGGATCTGGACACACCAAGTCCATTCTCAACCTTCGGACAAACACTGAGACCAACAATCCGTGTGCCAAGACAATTGTTAAGTTGTTTGAAATTCANAAAACAGGGTTNAACATACAGGACATGGANATTGTGGCCTCNGAGCATCTGCTGCACCAATCCCTTGTTGGCAAGCAGTCTCCATTTCAAAATGCTTACAACGTCAAGGGGAANGCCACCAGTGCCAANATCATCTAAAGCNNANAATNNTCTNCAATCAGCTTTNCC'; await page.getByTestId('Add a segment_segment_file').setInputFiles({ name: 'update_S.txt', mimeType: 'text/plain', - buffer: Buffer.from('>S\nAAAAA'), + buffer: Buffer.from('>S\n' + newSsequence), }); await page.getByRole('button', { name: 'Submit' }).click(); @@ -50,7 +52,7 @@ test('revising sequence data works: segment can be deleted; segment can be edite expect(tabs).toContain('S (unaligned)'); await reviewPage.switchSequenceTab('S (unaligned)'); - expect(await reviewPage.getSequenceContent()).toBe('AAAAA'); + expect(await reviewPage.getSequenceContent()).toBe(newSsequence); await reviewPage.closeSequencesDialog(); }); diff --git a/integration-tests/tests/specs/features/search/override-hidden-fields.spec.ts b/integration-tests/tests/specs/features/search/override-hidden-fields.spec.ts index e85f625060..43a3820298 100644 --- a/integration-tests/tests/specs/features/search/override-hidden-fields.spec.ts +++ b/integration-tests/tests/specs/features/search/override-hidden-fields.spec.ts @@ -21,7 +21,8 @@ test('Override hidden fields', async ({ page, groupId }) => { authorAffiliations: uuid, }, { - foo1: 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', + fastaHeader: + 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', }, ); await page.goto('/'); @@ -33,7 +34,8 @@ test('Override hidden fields', async ({ page, groupId }) => { authorAffiliations: uuid, }, { - foo1: 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', + fastaHeader: + 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', }, ); diff --git a/integration-tests/tests/specs/features/sequence-view.dependent.spec.ts b/integration-tests/tests/specs/features/sequence-view.dependent.spec.ts index c05cc17a8c..ce447cbf3a 100644 --- a/integration-tests/tests/specs/features/sequence-view.dependent.spec.ts +++ b/integration-tests/tests/specs/features/sequence-view.dependent.spec.ts @@ -11,25 +11,21 @@ test.describe('Sequence view in review card', () => { test.setTimeout(120000); void groupId; const submissionPage = new SingleSequenceSubmissionPage(page); - const submissionId = 'TEST_SEQ_VIEW'; await submissionPage.navigateToSubmissionPage('Crimean-Congo Hemorrhagic Fever Virus'); await submissionPage.fillSubmissionForm({ - submissionId: submissionId, + submissionId: 'TEST_SEQ_VIEW', collectionCountry: 'Brazil', collectionDate: '2023-01-15', authorAffiliations: 'Test Lab, University of Testing', }); - const fastaHeaderL = `${submissionId}_L`; - const fastaHeaderM = `${submissionId}_M`; - const fastaHeaderS = `${submissionId}_S`; await submissionPage.fillSequenceData({ - [fastaHeaderL]: + fastaHeaderL: 'CCACATTGACACAGANAGCTCCAGTAGTGGTTCTCTGTCCTTATTAAACCATGGACTTCTTAAGAAACCTTGACTGGACTCAGGTGATTGCTAGTCAGTATGTGACCAATCCC', - [fastaHeaderM]: + fastaHeaderM: 'GTGGATTGAGCATCTTAATTGCAGCATACTTGTCAACATCATGCATATATCATTGATGTATGCAGTTTTCTGCTTGCAGCTGTGCGGTCTAGGGAAAACTAACGGACTACACA', - [fastaHeaderS]: + fastaHeaderS: 'GTGTTCTCTTGAGTGTTGGCAAAATGGAAAACAAAATCGAGGTGAACAACAAAGATGAGATGAACAAATGGTTTGAGGAGTTCAAGAAAGGAAATGGACTTGTGGACACTTTC', }); await submissionPage.acceptTerms(); diff --git a/integration-tests/tests/specs/features/single-submit.spec.ts b/integration-tests/tests/specs/features/single-submit.spec.ts index 99b1ee2b25..b7a9390be0 100644 --- a/integration-tests/tests/specs/features/single-submit.spec.ts +++ b/integration-tests/tests/specs/features/single-submit.spec.ts @@ -5,17 +5,16 @@ test('submit a single sequence', async ({ page, groupId }) => { test.setTimeout(90_000); void groupId; const submissionPage = new SingleSequenceSubmissionPage(page); - const submissionId = 'TEST-ID-123'; await submissionPage.navigateToSubmissionPage(); await submissionPage.fillSubmissionForm({ - submissionId: submissionId, + submissionId: 'TEST-ID-123', collectionCountry: 'Uganda', collectionDate: '2023-10-15', authorAffiliations: 'Research Lab, University', }); await submissionPage.fillSequenceData({ - [submissionId]: + fastaHeader: 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', }); await submissionPage.acceptTerms(); @@ -27,16 +26,15 @@ test('submit a single sequence, all in one method', async ({ page, groupId }) => test.setTimeout(90_000); void groupId; const submissionPage = new SingleSequenceSubmissionPage(page); - const submissionId = 'TEST-ID-123'; await submissionPage.completeSubmission( { - submissionId: submissionId, + submissionId: 'TEST-ID-123', collectionCountry: 'Uganda', collectionDate: '2023-10-15', authorAffiliations: 'Research Lab, University', }, { - [submissionId]: + fastaHeader: 'ATTGATCTCATCATTTACCAATTGGAGACCGTTTAACTAGTCAATCCCCCATTTGGGGGCATTCCTAAAGTGTTGCAAAGGTATGTGGGTCGTATTGCTTTGCCTTTTCCTAACCTGGCTCCTCCTACAATTCTAACCTGCTTGATAAGTGTGATTACCTGAGTAATAGACTAATTTCGTCCTGGTAATTAGCATTTTCTAGTAAAACCAATACTATCTCAAGTCCTAAGAGGAGGTGAGAAGAGGGTCTCGAGGTATCCCTCCAGTCCACAAAATCTAGCTAATTTTAGCTGAGTGGACTGATTACTCTCATCACACGCTAACTACTAAGGGTTTACCTGAGAGCCTACAACATGGATAAACGGGTGAGAGGTTCATGGGCCCTGGGAGGACAATCTGAAGTTGATCTTGACTACCACAAAATATTAACAGCCGGGCTTTCGGTCCAACAAGGGATTGTGCGACAAAGAGTCATCCCGGTATATGTTGTGAGTGATCTTGAGGGTATTTGTCAACATATCATTCAGGCCTTTGAAGCAGGCGTAGATTTCCAAGATAATGCTGACAGCTTCCTTTTACTTTTATGTTTACATCATGCTTACCAAGGAGATCATAGGCTCTTCCTCAAAAGTGATGCAGTTCAATACTTAGAGGGCCATGGTTTCAGGTTTGAGGTCCGAGAAAAGGAGAATGTGCACCGTCTGGATGAATTGTTGCCCAATGTCACCGGTGGAAAAAATCTTAGGAGAACATTGGCTGCAATGCCTGAAGAGGAGACAACAGAAGCTAACGCTGGTCAGTTTTTATCCTTTGCCAGTTTGTTTCTACCCAAACTTGTCGTTGGGGAGAAAGCGTGTCTGGAAAAAGTACAAAGGCAGATTCAGGTCCATGCAGAACAAGGGCTCATTCAATATCCAACTTCCTGGCAATCAGTTGGACACATGATGGTGATCTTCCGTTTGATGAGAACAAACTTTTTAATCAAGTTCCTACTAATACATCAGGGGATGCACATGG', }, ); diff --git a/integration-tests/tests/specs/features/submission-flow.spec.ts b/integration-tests/tests/specs/features/submission-flow.spec.ts index 1825faa22b..14e7e1e7be 100644 --- a/integration-tests/tests/specs/features/submission-flow.spec.ts +++ b/integration-tests/tests/specs/features/submission-flow.spec.ts @@ -67,24 +67,20 @@ test.describe('Submission flow', () => { test.setTimeout(120_000); void groupId; const submissionPage = new SingleSequenceSubmissionPage(page); - const submissionId = 'XF499'; await submissionPage.navigateToSubmissionPage('Crimean-Congo Hemorrhagic Fever Virus'); await submissionPage.fillSubmissionForm({ - submissionId: submissionId, + submissionId: 'XF499', collectionCountry: 'Colombia', collectionDate: '2021-12-12', authorAffiliations: 'Research Lab, University of Example', }); - const fastaHeaderL = `${submissionId}_L`; - const fastaHeaderM = `${submissionId}_M`; - const fastaHeaderS = `${submissionId}_S`; await submissionPage.fillSequenceData({ - [fastaHeaderL]: + fastaHeaderL: 'CCACATTGACACAGANAGCTCCAGTAGTGGTTCTCTGTCCTTATTAAACCATGGACTTCTTAAGAAACCTTGACTGGACTCAGGTGATTGCTAGTCAGTATGTGACCAATCCCAGGTTTAATATCTCTGATTACTTCGAGATTGTTCGACAGCCTGGTGACGGGAACTGTTTCTACCACAGTATAGCTGAGTTAACCATGCCCAACAAAACAGATCACTCATACCATAACATCAAACATCTGACTGAGGTGGCAGCACGGAAGTATTATCAGGAGGAGCCGGAGGCTAAGCTCATTGGCCTGAGTCTGGAAGACTATCTTAAGAGGATGCTATCTGACAACGAATGGGGATCGACTCTTGAGGCATCTATGTTGGCTAAGGAAATGGGTATTACTATCATCATTTGGACTGTTGCAGCCAGTGACGAAGTGGAAGCAGGCATAAAGTTTGGTGATGGTGATGTGTTTACAGCCGTGAATCTTCTGCACTCCGGACAGACACACTTTGATGCCCTCAGAATACTGCCNCANTTTGAGGCTGACACAAGAGAGNCCTTNAGTCTGGTAGACAANNTNATAGCTGTGGACCANNTGACCTCNTCTTCAAGTGATGAANTGCAGGACTANGAAGANCTTGCTTTAGCACTTACNAGNGCGGAAGAACCATNTAGACGGTCTAGCNTGGATGAGGTNACCCTNTCTAAGAAACAAGCAGAGNTATTGAGGCAGAAGGCATCTCAGTTGTCNAAACTGGTTAATAAAAGTCAGAACATACCGACTAGAGTTGGCAGGGTTCTGGACTGTATGTTTAACTGCAAACTATGTGTTGAAATATCAGCTGACACTCTAATTCTGCGACCAGAATCTAAAGAAAGAATTGG', - [fastaHeaderM]: + fastaHeaderM: 'GTGGATTGAGCATCTTAATTGCAGCATACTTGTCAACATCATGCATATATCATTGATGTATGCAGTTTTCTGCTTGCAGCTGTGCGGTCTAGGGAAAACTAACGGACTACACAATGGGACTGAACACAATAAGACACACGTTATGACAACGCCTGATGACAGTCAGAGCCCTGAACCGCCAGTGAGCACAGCCCTGCCTGTCACACCGGACCCTTCCACTGTCACACCTACAACACCAGCCAGCGGATTAGAAGGCTCAGGAGAGGTTCACACATCCTCTCCAATCACCACCAAGGGTTTGTCTCTGCCGGGGGCTACATCTGAGCTCCCTGCGACTACTAGCATAGTCACTTCAGGTGCAAGTGATGCCGATTCTAGCACACAGGCAGCCAGAGACACCCCTAAACCATCAGTCCGCACGAGTCTGCCCAACAGCCCTAGCACACCATCCACACCACAAGGCACACACCATCCCGTGAGGAGTCTGCTTTCAGTCACGAGCCCTAAGCCAGAAGAAACACCAACACCGTCAAAATCAAGCAAAGATAGCTCAGCAACCAACAGTCCTCACCCAGCCGCCAGCAGACCAACAACCCCTCCCACAACAGCCCAGAGACCCGCTGAAAACAACAGCCACAACACCACCGAACAGCTTGAGTCCTTAACACAATTAGCAACTTCAGGTTCAATGATCTCTCCAACACAGACAGTCCTCCCAAAGAGTGTTACTTCTATAGCCATTCAAGACATTCATCCCAGCCCAACAAATAGGTCTAAAAGAAACCTTGATATGGAAATAATCT', - [fastaHeaderS]: + fastaHeaderS: 'GTGTTCTCTTGAGTGTTGGCAAAATGGAAAACAAAATCGAGGTGAACAACAAAGATGAGATGAACAAATGGTTTGAGGAGTTCAAGAAAGGAAATGGACTTGTGGACACTTTCACAAACTCNTATTCCTTTTGTGAAAGCGTNCCAAATCTGGACAGNTTTGTNTTCCAGATGGCNAGTGCCACTGATGATGCACAAAANGANTCCATCTACGCATCTGCNCTGGTGGANGCAACCAAATTTTGTGCACCTATATACGAGTGTGCTTGGGCTAGCTCCACTGGCATTGTTAAAAAGGGACTGGAGTGGTTCGAGAAAAATGCAGGAACCATTAAATCCTGGGATGAGAGTTATACTGAGCTTAAAGTTGAAGTTCCCAAAATAGAACAACTCTCCAACTACCAGCAGGCTGCTCTCAAATGGAGAAAAGACATAGGCTTCCGTGTCAATGCAAATACGGCAGCTTTGAGTAACAAAGTCCTAGCAGAGTACAAAGTTCCTGGCGAGATTGTAATGTCTGTCAAAGAGATGTTGTCAGATATGATTAGAAGNAGGAACCTGATTCTCAACAGAGGTGGTGATGAGAACCCACGCGGCCCAGTTAGCCGTGAACATGTGGAGTGGTGC', }); await submissionPage.acceptTerms(); diff --git a/integration-tests/tests/specs/features/trim-ns.spec.ts b/integration-tests/tests/specs/features/trim-ns.spec.ts index d9bcd1ad3b..49fb6b3731 100644 --- a/integration-tests/tests/specs/features/trim-ns.spec.ts +++ b/integration-tests/tests/specs/features/trim-ns.spec.ts @@ -22,9 +22,8 @@ test.describe('Sequence N trimming functionality', () => { const lSegmentWithNs = 'NNNNNNNNNNTTCAACAAGCAAAGCCAACTGTGACGGTGTTCTATATGCTAAAAGGTAACTTGATGAACACAGAGCCAACAGTTGCTGAGCTTGTCAGCTATGGTATAAAGGAAGGCAGGTTTTATAGGCTTTCCGACACCGGAATCAATGCAACCACATANNNNNN'; - const fastaHeaderL = 'TRIM_NS_TEST_L'; await submissionPage.fillSequenceData({ - [fastaHeaderL]: lSegmentWithNs, + fastaHeaderL: lSegmentWithNs, }); await submissionPage.acceptTerms(); diff --git a/kubernetes/loculus/templates/loculus-preprocessing-config.yaml b/kubernetes/loculus/templates/loculus-preprocessing-config.yaml index 51ecadf12e..47e5ca0091 100644 --- a/kubernetes/loculus/templates/loculus-preprocessing-config.yaml +++ b/kubernetes/loculus/templates/loculus-preprocessing-config.yaml @@ -2,7 +2,12 @@ {{- $metadata := ($organismConfig.schema | include "loculus.patchMetadataSchema" | fromYaml).metadata }} {{- $rawNucleotideSequences := (($organismConfig.schema | include "loculus.patchMetadataSchema" | fromYaml).nucleotideSequences) }} {{- $nucleotideSequences := ($rawNucleotideSequences | default "" ) }} -{{- $nucleotideSequencesList := (eq $rawNucleotideSequences nil | ternary (list "main") $rawNucleotideSequences) }} +{{- $referenceGenomes:= include "loculus.mergeReferenceGenomes" $organismConfig.referenceGenomes | fromYaml }} +{{- $genesList := (eq $referenceGenomes.genes nil | ternary (list) $referenceGenomes.genes) }} +{{- $genesDict := dict "genes" (list) -}} +{{- range $g := $genesList }} + {{- $_ := set $genesDict "genes" (append ($genesDict.genes) $g.name) -}} +{{- end }} {{- $flattened := include "loculus.flattenPreprocessingVersions" $organismConfig.preprocessing | fromJson }} {{- range $processingIndex, $processingConfig := $flattened.items }} {{- if $processingConfig.configFile }} @@ -18,7 +23,7 @@ data: preprocessing-config.yaml: | organism: {{ $organism }} {{- $preproAndEnaConfigFile | toYaml | nindent 4 }} - {{- (dict "nucleotideSequences" $nucleotideSequencesList) | toYaml | nindent 4 }} + {{- $genesDict | toYaml | nindent 4 }} processing_spec: {{- $args := dict "metadata" $metadata "nucleotideSequences" $nucleotideSequences }} {{- include "loculus.preprocessingSpecs" $args | nindent 6 }} diff --git a/kubernetes/loculus/values.schema.json b/kubernetes/loculus/values.schema.json index c3d4f7e25b..0f22052e10 100644 --- a/kubernetes/loculus/values.schema.json +++ b/kubernetes/loculus/values.schema.json @@ -604,7 +604,7 @@ "type": "boolean", "description": "If true run nextclade sort and require that the highest scoring match is in the config.accepted_dataset_matches" }, - "minimizer_url": { + "minimizer_index": { "groups": ["nextcladePipelineConfigFile"], "docsIncludePrefix": false, "type": "string", diff --git a/kubernetes/loculus/values.yaml b/kubernetes/loculus/values.yaml index 832a6ddf1a..4e6a958a43 100644 --- a/kubernetes/loculus/values.yaml +++ b/kubernetes/loculus/values.yaml @@ -1320,7 +1320,6 @@ defaultOrganismConfig: &defaultOrganismConfig replicas: 2 configFile: &preprocessingConfigFile log_level: DEBUG - genes: [] batch_size: 100 create_embl_file: true nextclade_dataset_server: https://data.clades.nextstrain.org/v3 @@ -1342,8 +1341,8 @@ defaultOrganisms: version: [1, 2] configFile: <<: *preprocessingConfigFile - genes: [NP, VP35, VP40, GP, sGP, ssGP, VP30, VP24, L] - nextclade_dataset_name: nextstrain/ebola/sudan + nucleotideSequences: + - nextclade_dataset_name: nextstrain/ebola/sudan nextclade_dataset_server: https://raw.githubusercontent.com/nextstrain/nextclade_data/ebola/data_output ingest: <<: *ingest @@ -1417,10 +1416,9 @@ defaultOrganisms: - <<: *preprocessing version: 1 configFile: - <<: *preprocessingConfigFile - nextclade_dataset_name: nextstrain/wnv/all-lineages + nucleotideSequences: + - nextclade_dataset_name: nextstrain/wnv/all-lineages nextclade_dataset_server: https://raw.githubusercontent.com/nextstrain/nextclade_data/wnv/data_output - genes: [capsid, prM, env, NS1, NS2A, NS2B, NS3, NS4A, 2K, NS4B, NS5] ingest: <<: *ingest configFile: @@ -1738,8 +1736,14 @@ defaultOrganisms: configFile: <<: *preprocessingConfigFile log_level: DEBUG - nextclade_dataset_name: community/pathoplexus/cchfv - genes: [RdRp, GPC, NP] + minimizer_index: https://loculus-project.github.io/nextclade-sort-minimizers/data/CCHF/minimizer.json + nucleotideSequences: + - name: L + nextclade_dataset_name: community/pathoplexus/cchfv/L + - name: M + nextclade_dataset_name: community/pathoplexus/cchfv/M + - name: S + nextclade_dataset_name: community/pathoplexus/cchfv/S ingest: <<: *ingest configFile: @@ -1853,10 +1857,22 @@ defaultOrganisms: - <<: *preprocessing configFile: <<: *preprocessingConfigFile - log_level: INFO - nextclade_dataset_name: community/hodcroftlab/enterovirus/enterovirus/linked + minimizer_index: "https://raw.githubusercontent.com/alejandra-gonzalezsanchez/loculus-evs/master/evs_minimizer-index.json" + nucleotideSequences: + - name: CV-A16 + nextclade_dataset_name: community/hodcroftlab/enterovirus/enterovirus/linked/CV-A16 + accepted_sort_matches: ["community/hodcroftlab/enterovirus/cva16", "community/hodcroftlab/enterovirus/enterovirus/linked/CV-A16"] + gene_prefix: "CV-A16-" + - name: CV-A10 + nextclade_dataset_name: community/hodcroftlab/enterovirus/enterovirus/linked/CV-A10 + gene_prefix: "CV-A10-" + - name: EV-A71 + nextclade_dataset_name: community/hodcroftlab/enterovirus/enterovirus/linked/EV-A71 + gene_prefix: "EV-A71-" + - name: EV-D68 + gene_prefix: "EV-D68-" + nextclade_dataset_name: community/hodcroftlab/enterovirus/enterovirus/linked/EV-D68 nextclade_dataset_server: https://raw.githubusercontent.com/alejandra-gonzalezsanchez/nextclade_data/multi-pathogen-evs/data_output - genes: ["CV-A16-VP4", "CV-A16-VP2", "CV-A16-VP3", "CV-A16-VP1", "CV-A16-2A", "CV-A16-2B", "CV-A16-2C", "CV-A16-3A", "CV-A16-3B", "CV-A16-3C", "CV-A16-3D", "CV-A10-VP4", "CV-A10-VP2", "CV-A10-VP3", "CV-A10-VP1", "CV-A10-2A", "CV-A10-2B", "CV-A10-2C", "CV-A10-3A", "CV-A10-3B", "CV-A10-3C", "CV-A10-3D", "EV-A71-VP4", "EV-A71-VP2", "EV-A71-VP3", "EV-A71-VP1", "EV-A71-2A", "EV-A71-2B", "EV-A71-2C", "EV-A71-3A", "EV-A71-3B", "EV-A71-3C", "EV-A71-3D", "EV-D68-VP4", "EV-D68-VP2", "EV-D68-VP3", "EV-D68-VP1", "EV-D68-2A", "EV-D68-2B", "EV-D68-2C", "EV-D68-3A", "EV-D68-3B", "EV-D68-3C", "EV-D68-3D"] ingest: <<: *ingest configFile: diff --git a/preprocessing/nextclade/src/loculus_preprocessing/backend.py b/preprocessing/nextclade/src/loculus_preprocessing/backend.py index 696a6eaee3..8fc48fbde1 100644 --- a/preprocessing/nextclade/src/loculus_preprocessing/backend.py +++ b/preprocessing/nextclade/src/loculus_preprocessing/backend.py @@ -124,7 +124,9 @@ def fetch_unprocessed_sequences( **({"If-None-Match": etag} if etag else {}), } logger.debug(f"[{request_id}] Requesting data with ETag: {etag}") - response = requests.post(url, data=params, headers=headers, timeout=config.backend_request_timeout_seconds) + response = requests.post( + url, data=params, headers=headers, timeout=config.backend_request_timeout_seconds + ) logger.info( f"[{request_id}] Unprocessed data from backend: status code {response.status_code}, " f"request id: {response.headers.get('x-request-id')}" @@ -181,7 +183,9 @@ def submit_processed_sequences( f"Data sent: {ndjson_string[:1000]}...\n" ) raise RuntimeError(msg) - logger.info(f"[{request_id}] Processed data submitted successfully, request id: {response.headers.get('x-request-id')}") + logger.info( + f"[{request_id}] Processed data submitted successfully, request id: {response.headers.get('x-request-id')}" + ) def request_upload(group_id: int, number_of_files: int, config: Config) -> Sequence[FileUploadInfo]: @@ -196,12 +200,16 @@ def request_upload(group_id: int, number_of_files: int, config: Config) -> Seque "Authorization": "Bearer " + get_jwt(config), "x-request-id": request_id, } - logger.info(f"[{request_id}] Requesting upload for {number_of_files} files, group_id: {group_id}") + logger.info( + f"[{request_id}] Requesting upload for {number_of_files} files, group_id: {group_id}" + ) response = requests.post(url, headers=headers, params=params, timeout=10) if not response.ok: msg = f"[{request_id}] Upload request failed: {response.status_code}, request id: {response.headers.get('x-request-id')}, {response.text}" raise RuntimeError(msg) - logger.info(f"[{request_id}] Upload request successful, request id: {response.headers.get('x-request-id')}") + logger.info( + f"[{request_id}] Upload request successful, request id: {response.headers.get('x-request-id')}" + ) return [FileUploadInfo(**item) for item in response.json()] diff --git a/preprocessing/nextclade/src/loculus_preprocessing/config.py b/preprocessing/nextclade/src/loculus_preprocessing/config.py index b0b87bba42..9c70d676d6 100644 --- a/preprocessing/nextclade/src/loculus_preprocessing/config.py +++ b/preprocessing/nextclade/src/loculus_preprocessing/config.py @@ -32,8 +32,21 @@ class AlignmentRequirement(StrEnum): # Determines whether ALL or ANY segments that a user provides must align. # ANY: warn if some segments fail and some segments align # ALL: error if any segment fails even if some segments align + # NONE: do not align any segments, just process them as-is + # - set if no nextclade dataset is provided ANY = "ANY" ALL = "ALL" + NONE = "NONE" + + +@dataclass +class NextcladeSequenceAndDataset: + name: str = "main" + nextclade_dataset_name: str | None = None + nextclade_dataset_tag: str | None = None + nextclade_dataset_server: str | None = None + accepted_sort_matches: list[str] = dataclasses.field(default_factory=list) + gene_prefix: str | None = None @dataclass @@ -53,21 +66,18 @@ class Config: organism: str = "mpox" genes: list[str] = dataclasses.field(default_factory=list) - nucleotideSequences: list[str] = dataclasses.field(default_factory=lambda: ["main"]) # noqa: N815 + nucleotideSequences: list[NextcladeSequenceAndDataset] = dataclasses.field( # noqa: N815 + default_factory=list + ) processing_spec: dict[str, dict[str, Any]] = dataclasses.field(default_factory=dict) multi_segment: bool = False alignment_requirement: AlignmentRequirement = AlignmentRequirement.ALL - nextclade_dataset_name: str | None = None - nextclade_dataset_name_map: dict[str, str] | None = None - nextclade_dataset_tag: str | None = None - nextclade_dataset_tag_map: dict[str, str] | None = None nextclade_dataset_server: str = "https://data.clades.nextstrain.org/v3" - nextclade_dataset_server_map: dict[str, str] | None = None require_nextclade_sort_match: bool = False - minimizer_url: str | None = None - accepted_dataset_matches: list[str] = dataclasses.field(default_factory=list) + minimizer_index: str | None = None + create_embl_file: bool = False scientific_name: str = "Orthonairovirus haemorrhagiae" molecule_type: MoleculeType = MoleculeType.GENOMIC_RNA @@ -79,6 +89,49 @@ class Config: ) +def get_accepted_sort_matches( + segment: NextcladeSequenceAndDataset, +) -> list[str]: + accepted_dataset_names = set() + + if segment.accepted_sort_matches: + accepted_dataset_names.update(segment.accepted_sort_matches) + if segment.nextclade_dataset_name: + accepted_dataset_names.add(segment.nextclade_dataset_name) + accepted_dataset_names.add(segment.name) + return list(accepted_dataset_names) + + +def assign_nextclade_sequence_and_dataset( + nuc_seq_values: list[dict[str, Any]], +) -> list[NextcladeSequenceAndDataset]: + if not isinstance(nuc_seq_values, list): + error_msg = f"nucleotideSequences should be a list of dicts, got: {type(nuc_seq_values)}" + logger.error(error_msg) + raise ValueError(error_msg) + nextclade_sequence_and_dataset_list: list[NextcladeSequenceAndDataset] = [] + for value in nuc_seq_values: + if value is None or not isinstance(value, dict): + continue + seq_and_dataset = NextcladeSequenceAndDataset() + for seq_key, seq_value in value.items(): + if hasattr(seq_and_dataset, seq_key) and seq_value is not None: + setattr(seq_and_dataset, seq_key, seq_value) + seq_and_dataset.accepted_sort_matches = get_accepted_sort_matches(seq_and_dataset) + nextclade_sequence_and_dataset_list.append(seq_and_dataset) + return nextclade_sequence_and_dataset_list + + +def set_alignment_requirement(config: Config) -> AlignmentRequirement: + need_nextclade_dataset: bool = False + for sequence in config.nucleotideSequences: + if sequence.nextclade_dataset_name: + need_nextclade_dataset = True + if not need_nextclade_dataset: + return AlignmentRequirement.NONE + return config.alignment_requirement + + def load_config_from_yaml(config_file: str, config: Config | None = None) -> Config: config = Config() if config is None else copy.deepcopy(config) with open(config_file, encoding="utf-8") as file: @@ -86,6 +139,9 @@ def load_config_from_yaml(config_file: str, config: Config | None = None) -> Con logger.debug(f"Loaded config from {config_file}: {yaml_config}") for key, value in yaml_config.items(): if value is not None and hasattr(config, key): + if key == "nucleotideSequences": + setattr(config, key, assign_nextclade_sequence_and_dataset(value)) + continue attr = getattr(config, key) if isinstance(attr, StrEnum): try: @@ -170,6 +226,8 @@ def get_config(config_file: str | None = None, ignore_args: bool = False) -> Con if not config.backend_host: # Set here so we can use organism config.backend_host = f"http://127.0.0.1:8079/{config.organism}" + config.alignment_requirement = set_alignment_requirement(config) + if len(config.nucleotideSequences) > 1: config.multi_segment = True diff --git a/preprocessing/nextclade/src/loculus_preprocessing/datatypes.py b/preprocessing/nextclade/src/loculus_preprocessing/datatypes.py index 4a4bc68569..4ede4970a4 100644 --- a/preprocessing/nextclade/src/loculus_preprocessing/datatypes.py +++ b/preprocessing/nextclade/src/loculus_preprocessing/datatypes.py @@ -80,6 +80,14 @@ class UnprocessedEntry: FunctionArgs = dict[ArgName, ArgValue] +@dataclass +class SegmentAssignment: + unalignedNucleotideSequences: dict[SegmentName, NucleotideSequence | None] # noqa: N815 + sequenceNameToFastaHeaderMap: dict[SegmentName, str] # noqa: N815 + errors: list[ProcessingAnnotation] + warnings: list[ProcessingAnnotation] + + @dataclass class ProcessingSpec: inputs: FunctionInputs @@ -99,6 +107,7 @@ class UnprocessedAfterNextclade: nucleotideInsertions: dict[SegmentName, list[NucleotideInsertion]] # noqa: N815 alignedAminoAcidSequences: dict[GeneName, AminoAcidSequence | None] # noqa: N815 aminoAcidInsertions: dict[GeneName, list[AminoAcidInsertion]] # noqa: N815 + sequenceNameToFastaHeaderMap: dict[SegmentName, str] # noqa: N815 errors: list[ProcessingAnnotation] warnings: list[ProcessingAnnotation] @@ -117,6 +126,7 @@ class ProcessedData: nucleotideInsertions: dict[SegmentName, Any] # noqa: N815 alignedAminoAcidSequences: dict[GeneName, Any] # noqa: N815 aminoAcidInsertions: dict[GeneName, Any] # noqa: N815 + sequenceNameToFastaHeaderMap: dict[SegmentName, str] # noqa: N815 files: dict[str, list[FileIdAndName]] | None = None diff --git a/preprocessing/nextclade/src/loculus_preprocessing/prepro.py b/preprocessing/nextclade/src/loculus_preprocessing/prepro.py index 6142da4cca..0d801c5f33 100644 --- a/preprocessing/nextclade/src/loculus_preprocessing/prepro.py +++ b/preprocessing/nextclade/src/loculus_preprocessing/prepro.py @@ -24,7 +24,7 @@ submit_processed_sequences, upload_embl_file_to_presigned_url, ) -from .config import AlignmentRequirement, Config +from .config import AlignmentRequirement, Config, NextcladeSequenceAndDataset from .datatypes import ( AccessionVersion, Alerts, @@ -45,6 +45,7 @@ ProcessingAnnotation, ProcessingResult, ProcessingSpec, + SegmentAssignment, SegmentName, SubmissionData, UnprocessedAfterNextclade, @@ -75,11 +76,12 @@ def parse_nextclade_tsv( ], result_dir: str, config: Config, - segment: SegmentName, + sequence_and_dataset: NextcladeSequenceAndDataset, ) -> tuple[ defaultdict[AccessionVersion, defaultdict[GeneName, list[AminoAcidInsertion]]], defaultdict[AccessionVersion, defaultdict[SegmentName, list[NucleotideInsertion]]], ]: + segment = sequence_and_dataset.name with Path(result_dir + "/nextclade.tsv").open(encoding="utf-8") as nextclade_tsv: reader = csv.DictReader(nextclade_tsv, delimiter="\t") for row in reader: @@ -94,7 +96,12 @@ def parse_nextclade_tsv( continue gene, val = ins.split(":", maxsplit=1) if gene in config.genes: - amino_acid_insertions[id][gene].append(val) + gene_name = ( + sequence_and_dataset.gene_prefix + gene + if sequence_and_dataset.gene_prefix + else gene + ) + amino_acid_insertions[id][gene_name].append(val) else: logger.debug( "Note: Nextclade found AA insertion in gene missing from config in gene " @@ -130,37 +137,27 @@ def parse_nextclade_json( def run_sort( - result_file_dir: str, + result_file: str, input_file: str, - alerts: Alerts, config: Config, - segment: SegmentName, + nextclade_dataset_server: str, dataset_dir: str, -) -> Alerts: +) -> pd.DataFrame: """ Run nextclade - - use config.minimizer_url or default minimizer from nextclade server - - assert highest score is in config.accepted_dataset_matches - (default is nextclade_dataset_name) + - use config.minimizer_index or default minimizer from nextclade server """ - nextclade_dataset_name = get_nextclade_dataset_name(config, segment) - if not config.accepted_dataset_matches and not nextclade_dataset_name: - logger.warning("No nextclade dataset name or accepted dataset match list found in config") - return alerts - nextclade_dataset_server = get_nextclade_dataset_server(config, segment) - - if config.minimizer_url: + if config.minimizer_index: minimizer_file = dataset_dir + "/minimizer/minimizer.json" - accepted_dataset_names = config.accepted_dataset_matches or [nextclade_dataset_name] # type: ignore + test = nextclade_dataset_server == "TEST" - result_file = result_file_dir + "/sort_output.tsv" - command = [ + subprocess_args_with_emtpy_strings = [ "nextclade3", "sort", input_file, - "-m" if config.minimizer_url else "", - f"{minimizer_file}" if config.minimizer_url else "", + "-m" if config.minimizer_index else "", + f"{minimizer_file}" if config.minimizer_index else "", "--output-results-tsv", f"{result_file}", "--max-score-gap", @@ -170,18 +167,18 @@ def run_sort( "--min-hits", "2", "--all-matches", - "--server", - f"{nextclade_dataset_server}", + "--server" if not test else "", + f"{nextclade_dataset_server}" if not test else "", ] + subprocess_args = [arg for arg in subprocess_args_with_emtpy_strings if arg] - logger.debug(f"Running nextclade sort: {command}") + logger.debug(f"Running nextclade sort: {subprocess_args}") - exit_code = subprocess.run(command, check=False).returncode # noqa: S603 + exit_code = subprocess.run(subprocess_args, check=False).returncode # noqa: S603 if exit_code != 0: msg = f"nextclade sort failed with exit code {exit_code}" raise Exception(msg) - - df = pd.read_csv( + return pd.read_csv( result_file, sep="\t", dtype={ @@ -192,6 +189,43 @@ def run_sort( }, ) + +def check_nextclade_sort_matches( # noqa: PLR0913, PLR0917 + result_file_dir: str, + input_file: str, + alerts: Alerts, + config: Config, + sequence_and_dataset: NextcladeSequenceAndDataset, + dataset_dir: str, +) -> Alerts: + """ + Run nextclade sort + - assert highest score is in sequence_and_dataset.accepted_sort_matches + (default is nextclade_dataset_name) + """ + nextclade_dataset_name = sequence_and_dataset.nextclade_dataset_name + if not sequence_and_dataset.accepted_sort_matches and not nextclade_dataset_name: + logger.warning("No nextclade dataset name or accepted dataset match list found in config") + return alerts + nextclade_dataset_server = ( + sequence_and_dataset.nextclade_dataset_server or config.nextclade_dataset_server + ) + + accepted_dataset_names = ( + sequence_and_dataset.accepted_sort_matches + or [nextclade_dataset_name] # type: ignore + or [sequence_and_dataset.name] # type: ignore + ) + + result_file = result_file_dir + "/sort_output.tsv" + df = run_sort( + result_file, + input_file, + config, + nextclade_dataset_server, + dataset_dir, + ) + hits = df.dropna(subset=["score"]).sort_values("score", ascending=False) best_hits = hits.groupby("seqName", as_index=False).first() @@ -208,7 +242,7 @@ def run_sort( "Sequence does not appear to match reference, per `nextclade sort`. " "Double check you are submitting to the correct organism." ), - ), + ) ) for _, row in best_hits.iterrows(): @@ -219,7 +253,7 @@ def run_sort( ProcessingAnnotationAlignment, AnnotationSourceType.NUCLEOTIDE_SEQUENCE, message=( - f"This sequence best matches {row['dataset']}, " + f"Sequence best matches {row['dataset']}, " "a different organism than the one you are submitting to: " f"{config.organism}. It is therefore not possible to release. " "Contact the administrator if you think this message is an error." @@ -230,42 +264,199 @@ def run_sort( return alerts -def assign_segment( +# TODO: running this for each sequence is inefficient, should be run once per batch +def assign_segment_with_nextclade_sort( input_unaligned_sequences: dict[str, NucleotideSequence | None], - unaligned_nucleotide_sequences: dict[SegmentName, NucleotideSequence | None], - errors: list[ProcessingAnnotation], config: Config, -): - valid_segments = set() - duplicate_segments = set() - if not config.nucleotideSequences: - return ( - unaligned_nucleotide_sequences, - errors, + dataset_dir: str, +) -> SegmentAssignment: + """ + Run nextclade sort + - assert highest score is in sequence_and_dataset.accepted_sort_matches + (default is nextclade_dataset_name) + """ + errors = [] + warnings = [] + unaligned_nucleotide_sequences: dict[SegmentName, NucleotideSequence | None] = {} + nextclade_dataset_server = config.nextclade_dataset_server + has_duplicate_segments = False + has_missing_segments = False + + with TemporaryDirectory(delete=not config.keep_tmp_dir) as result_dir: + input_file = result_dir + "/input.fasta" + os.makedirs(os.path.dirname(input_file), exist_ok=True) + with open(input_file, "w", encoding="utf-8") as f: + for id, seq in input_unaligned_sequences.items(): + f.write(f">{id}\n") + f.write(f"{seq}\n") + + result_file = result_dir + "/sort_output.tsv" + df = run_sort( + result_file, + input_file, + config, + nextclade_dataset_server, + dataset_dir, ) - if not config.multi_segment: - if len(input_unaligned_sequences) > 1: - errors.append( - ProcessingAnnotation.from_single( - ProcessingAnnotationAlignment, - AnnotationSourceType.NUCLEOTIDE_SEQUENCE, - message=( - f"Multiple sequences: {list(input_unaligned_sequences.keys())} found in the" - f" input data, but organism: {config.organism} is single-segmented. " - "Please check that your metadata and sequences are annotated correctly." - "Each metadata entry should have a single corresponding fasta sequence " - "entry with the same submissionId." - ), + + no_hits = df[df["score"].isna()] + hits = df.dropna(subset=["score"]).sort_values("score", ascending=False) + for seq_name in no_hits["seqName"].unique(): + if seq_name not in hits["seqName"].unique(): + msg = ( + f"Sequence with fasta header {seq_name} does not appear to match any reference for organism: " + f"{config.organism} per `nextclade sort`. " + f"Double check you are submitting to the correct organism." ) + if config.alignment_requirement == AlignmentRequirement.ALL: + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=msg, + ) + ) + else: + warnings.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=msg, + ) + ) + + best_hits = hits.groupby("seqName", as_index=False).first() + logger.info(f"Found hits: {best_hits['seqName'].tolist()}") + + sort_results_map: dict[SegmentName, list[str]] = {} + + for _, row in best_hits.iterrows(): + not_found = True + for segment in config.nucleotideSequences: + # TODO: need to check somewhere that accepted_sort_matches does not overlap across segments + if row["dataset"] in segment.accepted_sort_matches: + not_found = False + sort_results_map.setdefault(segment.name, []).append(row["seqName"]) + break + if not not_found: + continue + has_missing_segments = True + msg = ( + f"Sequence {row['seqName']} best matches {row['dataset']}, " + "which is currently not an accepted option for organism: " + f"{config.organism}. It is therefore not possible to release. " + "Contact the administrator if you think this message is an error." ) - else: - _, value = next(iter(input_unaligned_sequences.items())) - unaligned_nucleotide_sequences["main"] = value - return ( - unaligned_nucleotide_sequences, - errors, + if config.alignment_requirement == AlignmentRequirement.ALL: + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=msg, + ) + ) + else: + warnings.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=msg, + ) + ) + sequenceNameToFastaHeaderMap: dict[SegmentName, str] = {} + for segment_name, headers in sort_results_map.items(): + if len(headers) > 1: + msg = ( + f"Multiple sequences (with fasta headers: {', '.join(headers)}) align to " + f" {segment_name} - only one entry is allowed." + ) + has_duplicate_segments = True + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=msg, + ) + ) + continue + sequenceNameToFastaHeaderMap[segment_name] = headers[0] + unaligned_nucleotide_sequences[segment_name] = input_unaligned_sequences[headers[0]] + + if ( + len(unaligned_nucleotide_sequences) == 0 + and not has_duplicate_segments + and not has_missing_segments + ): + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message="No sequence data could be classified - check you are submitting to the correct organism.", + ) + ) + + return SegmentAssignment( + unalignedNucleotideSequences=unaligned_nucleotide_sequences, + sequenceNameToFastaHeaderMap=sequenceNameToFastaHeaderMap, + errors=errors, + warnings=warnings, + ) + + +def assign_single_segment( + input_unaligned_sequences: dict[str, NucleotideSequence | None], + config: Config, +) -> SegmentAssignment: + errors: list[ProcessingAnnotation] = [] + warnings: list[ProcessingAnnotation] = [] + unaligned_nucleotide_sequences: dict[SegmentName, NucleotideSequence | None] = {} + sequenceNameToFastaHeaderMap: dict[SegmentName, str] = {} + if len(input_unaligned_sequences) > 1: + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message=( + f"Multiple sequences: {list(input_unaligned_sequences.keys())} found in the" + f" input data, but organism: {config.organism} is single-segmented. " + "Please check that your metadata and sequences are annotated correctly." + "Each metadata entry should have a single corresponding fasta sequence " + "entry with the same submissionId." + ), + ) + ) + else: + fastaHeader, value = next(iter(input_unaligned_sequences.items())) + sequenceNameToFastaHeaderMap["main"] = fastaHeader + unaligned_nucleotide_sequences["main"] = value + return SegmentAssignment( + unalignedNucleotideSequences=unaligned_nucleotide_sequences, + sequenceNameToFastaHeaderMap=sequenceNameToFastaHeaderMap, + errors=errors, + warnings=warnings, + ) + + +def assign_segment_using_header( + input_unaligned_sequences: dict[str, NucleotideSequence | None], + config: Config, +) -> SegmentAssignment: + errors: list[ProcessingAnnotation] = [] + warnings: list[ProcessingAnnotation] = [] + unaligned_nucleotide_sequences: dict[SegmentName, NucleotideSequence | None] = {} + sequenceNameToFastaHeaderMap: dict[SegmentName, str] = {} + duplicate_segments = set() + if not config.nucleotideSequences: + return SegmentAssignment( + unalignedNucleotideSequences={}, + sequenceNameToFastaHeaderMap={}, + errors=errors, + warnings=warnings, ) - for segment in config.nucleotideSequences: + if not config.multi_segment: + return assign_single_segment(input_unaligned_sequences, config) + for sequence_and_dataset in config.nucleotideSequences: + segment = sequence_and_dataset.name unaligned_segment = [ data for data in input_unaligned_sequences @@ -288,11 +479,15 @@ def assign_segment( ) ) elif len(unaligned_segment) == 1: - valid_segments.add(unaligned_segment[0]) + sequenceNameToFastaHeaderMap[segment] = unaligned_segment[0] unaligned_nucleotide_sequences[segment] = input_unaligned_sequences[ unaligned_segment[0] ] - remaining_segments = set(input_unaligned_sequences.keys()) - valid_segments - duplicate_segments + remaining_segments = ( + set(input_unaligned_sequences.keys()) + - set(sequenceNameToFastaHeaderMap.values()) + - duplicate_segments + ) if len(remaining_segments) > 0: errors.append( ProcessingAnnotation.from_single( @@ -303,11 +498,24 @@ def assign_segment( f"{', '.join(remaining_segments)}. " "Each metadata entry can have multiple corresponding fasta sequence " "entries with format _ valid segments are: " - f"{', '.join(config.nucleotideSequences)}." + f"{', '.join([sequence_and_dataset.name for sequence_and_dataset in config.nucleotideSequences])}." ), ) ) - return (unaligned_nucleotide_sequences, errors) + if len(unaligned_nucleotide_sequences) == 0 and not duplicate_segments: + errors.append( + ProcessingAnnotation.from_single( + ProcessingAnnotationAlignment, + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + message="No sequence data found - ", + ) + ) + return SegmentAssignment( + unalignedNucleotideSequences=unaligned_nucleotide_sequences, + sequenceNameToFastaHeaderMap=sequenceNameToFastaHeaderMap, + errors=errors, + warnings=warnings, + ) def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 @@ -324,11 +532,13 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 nucleotideInsertions: dict[SegmentName, list[NucleotideInsertion]] alignedAminoAcidSequences: dict[GeneName, AminoAcidSequence | None] aminoAcidInsertions: dict[GeneName, list[AminoAcidInsertion]] + sequenceNameToFastaHeaderMap: dict[SegmentName, str] )` object. """ unaligned_nucleotide_sequences: dict[ AccessionVersion, dict[SegmentName, NucleotideSequence | None] ] = {} + segment_assignment_map: dict[AccessionVersion, dict[SegmentName, str]] = {} alerts: Alerts = Alerts() input_metadata: dict[AccessionVersion, dict[str, Any]] = {} aligned_aminoacid_sequences: dict[ @@ -341,22 +551,26 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 id = entry.accessionVersion input_metadata[id] = entry.data.metadata input_metadata[id]["submitter"] = entry.data.submitter - input_metadata[id]["group_id"] = entry.data.group_id input_metadata[id]["submittedAt"] = entry.data.submittedAt + input_metadata[id]["group_id"] = entry.data.group_id aligned_aminoacid_sequences[id] = {} - unaligned_nucleotide_sequences[id] = {} aligned_nucleotide_sequences[id] = {} - alerts.warnings[id] = [] - alerts.errors[id] = [] - ( - unaligned_nucleotide_sequences[id], - alerts.errors[id], - ) = assign_segment( - input_unaligned_sequences=entry.data.unalignedNucleotideSequences, - unaligned_nucleotide_sequences=unaligned_nucleotide_sequences[id], - errors=alerts.errors[id], - config=config, - ) + segment_assignment_map[id] = {} + if not config.multi_segment: + segment_assignment = assign_single_segment( + input_unaligned_sequences=entry.data.unalignedNucleotideSequences, + config=config, + ) + else: + segment_assignment = assign_segment_with_nextclade_sort( + input_unaligned_sequences=entry.data.unalignedNucleotideSequences, + config=config, + dataset_dir=dataset_dir, + ) + unaligned_nucleotide_sequences[id] = segment_assignment.unalignedNucleotideSequences + alerts.errors[id] = segment_assignment.errors + alerts.warnings[id] = segment_assignment.warnings + segment_assignment_map[id] = segment_assignment.sequenceNameToFastaHeaderMap nextclade_metadata: defaultdict[ AccessionVersion, defaultdict[SegmentName, dict[str, Any] | None] @@ -368,9 +582,12 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 AccessionVersion, defaultdict[GeneName, list[AminoAcidInsertion]] ] = defaultdict(lambda: defaultdict(list)) with TemporaryDirectory(delete=not config.keep_tmp_dir) as result_dir: # noqa: PLR1702 - for segment in config.nucleotideSequences: - result_dir_seg = result_dir if segment == "main" else result_dir + "/" + segment - dataset_dir_seg = dataset_dir if segment == "main" else dataset_dir + "/" + segment + for sequence_and_dataset in config.nucleotideSequences: + segment = sequence_and_dataset.name + result_dir_seg = result_dir if not config.multi_segment else result_dir + "/" + segment + dataset_dir_seg = ( + dataset_dir if not config.multi_segment else dataset_dir + "/" + segment + ) input_file = result_dir_seg + "/input.fasta" os.makedirs(os.path.dirname(input_file), exist_ok=True) is_empty: bool = True @@ -384,7 +601,9 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 continue if config.require_nextclade_sort_match: - alerts = run_sort(result_dir_seg, input_file, alerts, config, segment, dataset_dir) + alerts = check_nextclade_sort_matches( + result_dir_seg, input_file, alerts, config, sequence_and_dataset, dataset_dir + ) command = [ "nextclade3", @@ -422,7 +641,12 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 masked_sequence = mask_terminal_gaps( str(aligned_sequence.seq), mask_char="X" ) - aligned_aminoacid_sequences[sequence_id][gene] = masked_sequence + gene_name = ( + sequence_and_dataset.gene_prefix + gene + if sequence_and_dataset.gene_prefix + else gene + ) + aligned_aminoacid_sequences[sequence_id][gene_name] = masked_sequence except FileNotFoundError: # TODO: Add warning to each sequence logger.info( @@ -435,7 +659,11 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 result_dir_seg, nextclade_metadata, segment, unaligned_nucleotide_sequences ) # this includes the "annotation" field amino_acid_insertions, nucleotide_insertions = parse_nextclade_tsv( - amino_acid_insertions, nucleotide_insertions, result_dir_seg, config, segment + amino_acid_insertions, + nucleotide_insertions, + result_dir_seg, + config, + sequence_and_dataset, ) return { @@ -447,6 +675,7 @@ def enrich_with_nextclade( # noqa: C901, PLR0914, PLR0915 nucleotideInsertions=nucleotide_insertions[id], alignedAminoAcidSequences=aligned_aminoacid_sequences[id], aminoAcidInsertions=amino_acid_insertions[id], + sequenceNameToFastaHeaderMap=segment_assignment_map[id], errors=alerts.errors[id], warnings=alerts.warnings[id], ) @@ -556,7 +785,7 @@ def add_input_metadata( if not unprocessed.nextcladeMetadata[segment]: message = ( "Nucleotide sequence failed to align" - if segment == "main" + if not config.multi_segment else f"Nucleotide sequence for {segment} failed to align" ) annotation = ProcessingAnnotation.from_single( @@ -652,6 +881,7 @@ def processed_entry_no_alignment( output_metadata: ProcessedMetadata, errors: list[ProcessingAnnotation], warnings: list[ProcessingAnnotation], + sequenceNameToFastaHeaderMap: dict[SegmentName, str], ) -> SubmissionData: """Process a single sequence without alignment""" @@ -671,6 +901,7 @@ def processed_entry_no_alignment( nucleotideInsertions=nucleotide_insertions, alignedAminoAcidSequences=aligned_aminoacid_sequences, aminoAcidInsertions=amino_acid_insertions, + sequenceNameToFastaHeaderMap=sequenceNameToFastaHeaderMap, ), errors=errors, warnings=warnings, @@ -679,7 +910,7 @@ def processed_entry_no_alignment( ) -def process_single( # noqa: C901, PLR0912 +def process_single( # noqa: C901 id: AccessionVersion, unprocessed: UnprocessedAfterNextclade | UnprocessedData, config: Config ) -> SubmissionData: """Process a single sequence per config""" @@ -694,36 +925,30 @@ def process_single( # noqa: C901, PLR0912 warnings += unprocessed.warnings if unprocessed.errors: errors += unprocessed.errors - elif not any(unprocessed.unalignedNucleotideSequences.values()): - errors.append( - ProcessingAnnotation.from_single( - ProcessingAnnotationAlignment, - AnnotationSourceType.NUCLEOTIDE_SEQUENCE, - message="No sequence data found - check segments are annotated correctly", - ) - ) submitter = unprocessed.inputMetadata["submitter"] group_id = int(str(unprocessed.inputMetadata["group_id"])) else: submitter = unprocessed.submitter group_id = unprocessed.group_id - unprocessed.unalignedNucleotideSequences, errors = assign_segment( + segment_assignment = assign_segment_using_header( input_unaligned_sequences=unprocessed.unalignedNucleotideSequences, - unaligned_nucleotide_sequences={}, - errors=errors, config=config, ) + unprocessed.unalignedNucleotideSequences = segment_assignment.unalignedNucleotideSequences + errors += segment_assignment.errors + warnings += segment_assignment.warnings - for segment in config.nucleotideSequences: + for sequence_and_dataset in config.nucleotideSequences: + segment = sequence_and_dataset.name sequence = unprocessed.unalignedNucleotideSequences.get(segment, None) - key = "length" if segment == "main" else "length_" + segment + key = "length" if not config.multi_segment else "length_" + segment if key in config.processing_spec: output_metadata[key] = len(sequence) if sequence else 0 for output_field, spec_dict in config.processing_spec.items(): length_fields = [ - "length" if segment == "main" else "length_" + segment + "length" if not config.multi_segment else "length_" + segment.name for segment in config.nucleotideSequences ] if output_field in length_fields: @@ -761,14 +986,26 @@ def process_single( # noqa: C901, PLR0912 logger.debug(f"Processed {id}: {output_metadata}") if isinstance(unprocessed, UnprocessedData): - return processed_entry_no_alignment(id, unprocessed, output_metadata, errors, warnings) + return processed_entry_no_alignment( + id, + unprocessed, + output_metadata, + errors, + warnings, + segment_assignment.sequenceNameToFastaHeaderMap, + ) aligned_segments = set() - for segment in config.nucleotideSequences: + for sequence_and_dataset in config.nucleotideSequences: + segment = sequence_and_dataset.name if unprocessed.alignedNucleotideSequences.get(segment, None): aligned_segments.add(segment) - if not aligned_segments and config.multi_segment: + if ( + not aligned_segments + and config.multi_segment + and len(unprocessed.unalignedNucleotideSequences) > 0 + ): errors.append( ProcessingAnnotation.from_single( ProcessingAnnotationAlignment, @@ -781,7 +1018,8 @@ def process_single( # noqa: C901, PLR0912 if config.create_embl_file and unprocessed.nextcladeMetadata is not None: annotations = {} - for segment in config.nucleotideSequences: + for sequence_and_dataset in config.nucleotideSequences: + segment = sequence_and_dataset.name if segment in unprocessed.nextcladeMetadata: annotations[segment] = None if unprocessed.nextcladeMetadata[segment]: @@ -799,6 +1037,7 @@ def process_single( # noqa: C901, PLR0912 nucleotideInsertions=unprocessed.nucleotideInsertions, alignedAminoAcidSequences=unprocessed.alignedAminoAcidSequences, aminoAcidInsertions=unprocessed.aminoAcidInsertions, + sequenceNameToFastaHeaderMap=unprocessed.sequenceNameToFastaHeaderMap, ), errors=list(set(errors)), warnings=list(set(warnings)), @@ -824,6 +1063,7 @@ def processed_entry_with_errors(id) -> SubmissionData: nucleotideInsertions=defaultdict(dict[str, Any]), alignedAminoAcidSequences=defaultdict(dict[str, Any]), aminoAcidInsertions=defaultdict(dict[str, Any]), + sequenceNameToFastaHeaderMap=defaultdict(str), ), errors=[ ProcessingAnnotation.from_single( @@ -846,7 +1086,7 @@ def process_all( ) -> Sequence[SubmissionData]: processed_results = [] logger.debug(f"Processing {len(unprocessed)} unprocessed sequences") - if config.nextclade_dataset_name: + if config.alignment_requirement != AlignmentRequirement.NONE: nextclade_results = enrich_with_nextclade(unprocessed, dataset_dir, config) for id, result in nextclade_results.items(): try: @@ -867,37 +1107,15 @@ def process_all( return processed_results -def get_nextclade_dataset_name(config: Config, segment: SegmentName) -> str | None: - if config.nextclade_dataset_name_map and segment in config.nextclade_dataset_name_map: - return config.nextclade_dataset_name_map[segment] - if not config.nextclade_dataset_name: - return None - return ( - config.nextclade_dataset_name - if segment == "main" - else config.nextclade_dataset_name + "/" + segment - ) - - -def get_nextclade_dataset_server(config: Config, segment: SegmentName) -> str: - if config.nextclade_dataset_server_map and segment in config.nextclade_dataset_server_map: - return config.nextclade_dataset_server_map[segment] - return config.nextclade_dataset_server - - -def get_nextclade_dataset_tag(config: Config, segment: SegmentName) -> str | None: - if config.nextclade_dataset_tag_map and segment in config.nextclade_dataset_tag_map: - return config.nextclade_dataset_tag_map[segment] - return config.nextclade_dataset_tag - - def download_nextclade_dataset(dataset_dir: str, config: Config) -> None: - for segment in config.nucleotideSequences: - nextclade_dataset_name = get_nextclade_dataset_name(config, segment) - nextclade_dataset_server = get_nextclade_dataset_server(config, segment) - nextclade_dataset_tag = get_nextclade_dataset_tag(config, segment) + for sequence_and_dataset in config.nucleotideSequences: + name = sequence_and_dataset.name + nextclade_dataset_name = sequence_and_dataset.nextclade_dataset_name + nextclade_dataset_server = ( + sequence_and_dataset.nextclade_dataset_server or config.nextclade_dataset_server + ) - dataset_dir_seg = dataset_dir if segment == "main" else dataset_dir + "/" + segment + dataset_dir_seg = dataset_dir if not config.multi_segment else dataset_dir + "/" + name dataset_download_command = [ "nextclade3", "dataset", @@ -907,8 +1125,8 @@ def download_nextclade_dataset(dataset_dir: str, config: Config) -> None: f"--output-dir={dataset_dir_seg}", ] - if nextclade_dataset_tag is not None: - dataset_download_command.append(f"--tag={nextclade_dataset_tag}") + if sequence_and_dataset.nextclade_dataset_tag is not None: + dataset_download_command.append(f"--tag={sequence_and_dataset.nextclade_dataset_tag}") logger.info("Downloading Nextclade dataset: %s", dataset_download_command) if subprocess.run(dataset_download_command, check=False).returncode != 0: # noqa: S603 @@ -952,10 +1170,10 @@ def upload_flatfiles(processed: Sequence[SubmissionData], config: Config) -> Non def run(config: Config) -> None: with TemporaryDirectory(delete=not config.keep_tmp_dir) as dataset_dir: - if config.nextclade_dataset_name: + if config.alignment_requirement != AlignmentRequirement.NONE: download_nextclade_dataset(dataset_dir, config) - if config.minimizer_url and config.require_nextclade_sort_match: - download_minimizer(config.minimizer_url, dataset_dir + "/minimizer/minimizer.json") + if config.minimizer_index: + download_minimizer(config.minimizer_index, dataset_dir + "/minimizer/minimizer.json") total_processed = 0 etag = None last_force_refresh = time.time() diff --git a/preprocessing/nextclade/tests/ebola-dataset/minimizer/minimizer.json b/preprocessing/nextclade/tests/ebola-dataset/minimizer/minimizer.json new file mode 100644 index 0000000000..81b74b890b --- /dev/null +++ b/preprocessing/nextclade/tests/ebola-dataset/minimizer/minimizer.json @@ -0,0 +1 @@ +{"schemaVersion": "3.0.0", "version": "1", "params": {"k": 17, "cutoff": 2147483648}, "minimizers": {"69543": [0, 1], "71846": [0, 1], "170137": [0], "390225": [0], "695790": [0], "891801": [0], "1021124": [0], "1236686": [0], "1315823": [0], "1361598": [0], "1489080": [0], "1638488": [0], "1712786": [0], "1744960": [0], "2205906": [0], "2207683": [0], "2232227": [0], "2256261": [0], "2314094": [0], "2657358": [0], "2860514": [0], "3019789": [0], "3332777": [0, 1], "3374274": [0], "3381333": [0], "3519654": [0], "3618250": [0], "4380772": [0], "4790460": [0], "5017706": [0], "5817014": [0], 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a/preprocessing/nextclade/tests/factory_methods.py +++ b/preprocessing/nextclade/tests/factory_methods.py @@ -46,7 +46,7 @@ class ProcessingAnnotationHelper: @dataclass class ProcessedAlignment: unalignedNucleotideSequences: dict[str, str | None] = field( # noqa: N815 - default_factory=lambda: {"main": None} + default_factory=dict ) alignedNucleotideSequences: dict[str, str | None] = field( # noqa: N815 default_factory=dict @@ -54,6 +54,9 @@ class ProcessedAlignment: nucleotideInsertions: dict[str, list[str]] = field(default_factory=dict) # noqa: N815 alignedAminoAcidSequences: dict[str, str | None] = field(default_factory=dict) # noqa: N815 aminoAcidInsertions: dict[str, list[str]] = field(default_factory=dict) # noqa: N815 + sequenceNameToFastaHeaderMap: dict[str, str] = field( # noqa: N815 + default_factory=dict + ) @dataclass @@ -140,6 +143,7 @@ def create_processed_entry( nucleotideInsertions=processed_alignment.nucleotideInsertions, alignedAminoAcidSequences=processed_alignment.alignedAminoAcidSequences, aminoAcidInsertions=processed_alignment.aminoAcidInsertions, + sequenceNameToFastaHeaderMap=processed_alignment.sequenceNameToFastaHeaderMap, ), errors=errors, warnings=warnings, @@ -242,3 +246,7 @@ def verify_processed_entry( f"{test_name}: amino acid insertions '{actual.aminoAcidInsertions}' do not " f"match expectation '{expected.aminoAcidInsertions}'." ) + assert actual.sequenceNameToFastaHeaderMap == expected.sequenceNameToFastaHeaderMap, ( + f"{test_name}: sequence name to fasta header map '{actual.sequenceNameToFastaHeaderMap}' do not " + f"match expectation '{expected.sequenceNameToFastaHeaderMap}'." + ) diff --git a/preprocessing/nextclade/tests/multi_segment_config.yaml b/preprocessing/nextclade/tests/multi_segment_config.yaml index bfac8b94e7..eb4d5099d7 100644 --- a/preprocessing/nextclade/tests/multi_segment_config.yaml +++ b/preprocessing/nextclade/tests/multi_segment_config.yaml @@ -6,11 +6,15 @@ genes: - VP24EbolaZaire - LEbolaZaire log_level: DEBUG -nextclade_dataset_name: ebola-dataset -nextclade_dataset_server: fake_url +minimizer_index: TEST +nextclade_dataset_server: TEST nucleotideSequences: -- ebola-sudan -- ebola-zaire +- name: ebola-sudan + nextclade_dataset_name: ebola-dataset/ebola-sudan + accepted_sort_matches: ebola-sudan +- name: ebola-zaire + nextclade_dataset_name: ebola-dataset/ebola-zaire + accepted_sort_matches: ebola-zaire organism: multi-ebola-test processing_spec: totalInsertedNucs_ebola-zaire: diff --git a/preprocessing/nextclade/tests/multi_segment_config_unaligned.yaml b/preprocessing/nextclade/tests/multi_segment_config_unaligned.yaml new file mode 100644 index 0000000000..bc82c15079 --- /dev/null +++ b/preprocessing/nextclade/tests/multi_segment_config_unaligned.yaml @@ -0,0 +1,23 @@ +batch_size: 100 +alignment_requirement: NONE +log_level: DEBUG +minimizer_index: TEST +nucleotideSequences: +- name: ebola-sudan +- name: ebola-zaire +organism: multi-ebola-test +processing_spec: + length_ebola-sudan: + args: + segment: ebola-sudan + type: int + function: identity + inputs: + input: length_ebola-sudan + length_ebola-zaire: + args: + segment: ebola-zaire + type: int + function: identity + inputs: + input: length_ebola-zaire diff --git a/preprocessing/nextclade/tests/single_segment_config.yaml b/preprocessing/nextclade/tests/single_segment_config.yaml index 670665961c..064beb1a72 100644 --- a/preprocessing/nextclade/tests/single_segment_config.yaml +++ b/preprocessing/nextclade/tests/single_segment_config.yaml @@ -3,14 +3,14 @@ genes: - NPEbolaSudan - VP35EbolaSudan log_level: DEBUG -nextclade_dataset_name: ebola-sudan-test-dataset -nextclade_dataset_server: fake_url +nextclade_dataset_server: TEST scientific_name: "Test Ebola Sudan Virus" molecule_type: "genomic RNA" topology: "linear" db_name: "Loculus" +minimizer_index: TEST nucleotideSequences: -- main +- nextclade_dataset_name: ebola-sudan-test-dataset organism: ebola-sudan-test processing_spec: completeness: diff --git a/preprocessing/nextclade/tests/test_nextclade_preprocessing.py b/preprocessing/nextclade/tests/test_nextclade_preprocessing.py index 262b2561aa..bbb4bfc5f8 100644 --- a/preprocessing/nextclade/tests/test_nextclade_preprocessing.py +++ b/preprocessing/nextclade/tests/test_nextclade_preprocessing.py @@ -34,6 +34,7 @@ # Config file used for testing SINGLE_SEGMENT_CONFIG = "tests/single_segment_config.yaml" MULTI_SEGMENT_CONFIG = "tests/multi_segment_config.yaml" +MULTI_SEGMENT_CONFIG_UNALIGNED = "tests/multi_segment_config_unaligned.yaml" EMBL_METADATA = "tests/embl_required_metadata.yaml" EBOLA_SUDAN_DATASET = "tests/ebola-dataset/ebola-sudan" @@ -114,7 +115,7 @@ def invalid_sequence() -> str: Case( name="with mutation", input_metadata={}, - input_sequence={"main": sequence_with_mutation("single")}, + input_sequence={"fastaHeader": sequence_with_mutation("single")}, accession_id="1", expected_metadata={ "completeness": 1.0, @@ -134,12 +135,13 @@ def invalid_sequence() -> str: "VP35EbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "VP35"), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"main": "fastaHeader"}, ), ), Case( name="with insertion", input_metadata={}, - input_sequence={"main": sequence_with_insertion("single")}, + input_sequence={"fastaHeader": sequence_with_insertion("single")}, accession_id="1", expected_metadata={ "completeness": 1.0, @@ -159,12 +161,13 @@ def invalid_sequence() -> str: "VP35EbolaSudan": ebola_sudan_aa(consensus_sequence("single"), "VP35"), }, aminoAcidInsertions={"NPEbolaSudan": ["738:D"]}, + sequenceNameToFastaHeaderMap={"main": "fastaHeader"}, ), ), Case( name="with deletion", input_metadata={}, - input_sequence={"main": sequence_with_deletion("single")}, + input_sequence={"fastaHeader": sequence_with_deletion("single")}, accession_id="1", expected_metadata={ "completeness": 1.0, @@ -188,12 +191,13 @@ def invalid_sequence() -> str: ), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"main": "fastaHeader"}, ), ), Case( name="with failed alignment", input_metadata={}, - input_sequence={"main": invalid_sequence()}, + input_sequence={"fastaHeader": invalid_sequence()}, accession_id="1", expected_metadata={ "completeness": None, @@ -217,6 +221,7 @@ def invalid_sequence() -> str: nucleotideInsertions={}, alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"main": "fastaHeader"}, ), ), ] @@ -226,8 +231,8 @@ def invalid_sequence() -> str: name="with mutation", input_metadata={}, input_sequence={ - "ebola-sudan": sequence_with_mutation("ebola-sudan"), - "ebola-zaire": sequence_with_mutation("ebola-zaire"), + "fastaHeader1": sequence_with_mutation("ebola-sudan"), + "fastaHeader2": sequence_with_mutation("ebola-zaire"), }, accession_id="1", expected_metadata={ @@ -259,14 +264,18 @@ def invalid_sequence() -> str: "LEbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "L"), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={ + "ebola-sudan": "fastaHeader1", + "ebola-zaire": "fastaHeader2", + }, ), ), Case( name="with insertion", input_metadata={}, input_sequence={ - "ebola-sudan": sequence_with_insertion("ebola-sudan"), - "ebola-zaire": sequence_with_insertion("ebola-zaire"), + "fastaHeader1": sequence_with_insertion("ebola-sudan"), + "fastaHeader2": sequence_with_insertion("ebola-zaire"), }, accession_id="1", expected_metadata={ @@ -298,14 +307,18 @@ def invalid_sequence() -> str: "LEbolaZaire": ebola_zaire_aa(consensus_sequence("ebola-zaire"), "L"), }, aminoAcidInsertions={"NPEbolaSudan": ["738:D"], "VP24EbolaZaire": ["251:D"]}, + sequenceNameToFastaHeaderMap={ + "ebola-sudan": "fastaHeader1", + "ebola-zaire": "fastaHeader2", + }, ), ), Case( name="with deletion", input_metadata={}, input_sequence={ - "ebola-sudan": sequence_with_deletion("ebola-sudan"), - "ebola-zaire": sequence_with_deletion("ebola-zaire"), + "fastaHeader1": sequence_with_deletion("ebola-sudan"), + "fastaHeader2": sequence_with_deletion("ebola-zaire"), }, accession_id="1", expected_metadata={ @@ -347,13 +360,17 @@ def invalid_sequence() -> str: ), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={ + "ebola-sudan": "fastaHeader1", + "ebola-zaire": "fastaHeader2", + }, ), ), Case( name="with one succeeded and one not uploaded", input_metadata={}, input_sequence={ - "ebola-zaire": sequence_with_mutation("ebola-zaire"), + "fastaHeader2": sequence_with_mutation("ebola-zaire"), }, accession_id="1", expected_metadata={ @@ -381,6 +398,7 @@ def invalid_sequence() -> str: "LEbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "L"), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"ebola-zaire": "fastaHeader2"}, ), ), ] @@ -389,13 +407,13 @@ def invalid_sequence() -> str: Case( name="with one failed alignment, one not uploaded", input_metadata={}, - input_sequence={"ebola-sudan": invalid_sequence()}, + input_sequence={"fastaHeader1": invalid_sequence()}, accession_id="1", expected_metadata={ "totalInsertedNucs_ebola-sudan": None, "totalSnps_ebola-sudan": None, "totalDeletedNucs_ebola-sudan": None, - "length_ebola-sudan": 53, + "length_ebola-sudan": 0, "totalInsertedNucs_ebola-zaire": None, "totalSnps_ebola-zaire": None, "totalDeletedNucs_ebola-zaire": None, @@ -403,42 +421,41 @@ def invalid_sequence() -> str: }, expected_errors=[ ProcessingAnnotationHelper( - [ProcessingAnnotationAlignment], - [ProcessingAnnotationAlignment], - "No segment aligned.", + ["alignment"], + ["alignment"], + "Sequence with fasta header fastaHeader1 does not appear to match any reference for organism: multi-ebola-test per `nextclade sort`. Double check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ), ProcessingAnnotationHelper( - ["ebola-sudan"], - ["ebola-sudan"], - "Nucleotide sequence for ebola-sudan failed to align", + [ProcessingAnnotationAlignment], + [ProcessingAnnotationAlignment], + "No sequence data could be classified - check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ), ], expected_warnings=[], expected_processed_alignment=ProcessedAlignment( - unalignedNucleotideSequences={ - "ebola-sudan": invalid_sequence(), - }, + unalignedNucleotideSequences={}, alignedNucleotideSequences={}, nucleotideInsertions={}, alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={}, ), ), Case( name="with one failed alignment, one succeeded", input_metadata={}, input_sequence={ - "ebola-sudan": invalid_sequence(), - "ebola-zaire": sequence_with_mutation("ebola-zaire"), + "fastaHeader1": invalid_sequence(), + "fastaHeader2": sequence_with_mutation("ebola-zaire"), }, accession_id="1", expected_metadata={ "totalInsertedNucs_ebola-sudan": None, "totalSnps_ebola-sudan": None, "totalDeletedNucs_ebola-sudan": None, - "length_ebola-sudan": 53, + "length_ebola-sudan": 0, "totalInsertedNucs_ebola-zaire": 0, "totalSnps_ebola-zaire": 1, "totalDeletedNucs_ebola-zaire": 0, @@ -446,16 +463,15 @@ def invalid_sequence() -> str: }, expected_errors=[ ProcessingAnnotationHelper( - ["ebola-sudan"], - ["ebola-sudan"], - "Nucleotide sequence for ebola-sudan failed to align", + ["alignment"], + ["alignment"], + "Sequence with fasta header fastaHeader1 does not appear to match any reference for organism: multi-ebola-test per `nextclade sort`. Double check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ), ], expected_warnings=[], expected_processed_alignment=ProcessedAlignment( unalignedNucleotideSequences={ - "ebola-sudan": invalid_sequence(), "ebola-zaire": sequence_with_mutation("ebola-zaire"), }, alignedNucleotideSequences={ @@ -467,6 +483,7 @@ def invalid_sequence() -> str: "LEbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "L"), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"ebola-zaire": "fastaHeader2"}, ), ), ] @@ -475,13 +492,13 @@ def invalid_sequence() -> str: Case( name="with one failed alignment, one not uploaded", input_metadata={}, - input_sequence={"ebola-sudan": invalid_sequence()}, + input_sequence={"fastaHeader1": invalid_sequence()}, accession_id="1", expected_metadata={ "totalInsertedNucs_ebola-sudan": None, "totalSnps_ebola-sudan": None, "totalDeletedNucs_ebola-sudan": None, - "length_ebola-sudan": 53, + "length_ebola-sudan": 0, "totalInsertedNucs_ebola-zaire": None, "totalSnps_ebola-zaire": None, "totalDeletedNucs_ebola-zaire": None, @@ -491,41 +508,40 @@ def invalid_sequence() -> str: ProcessingAnnotationHelper( [ProcessingAnnotationAlignment], [ProcessingAnnotationAlignment], - "No segment aligned.", + "No sequence data could be classified - check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ) ], expected_warnings=[ ProcessingAnnotationHelper( - ["ebola-sudan"], - ["ebola-sudan"], - "Nucleotide sequence for ebola-sudan failed to align", + ["alignment"], + ["alignment"], + "Sequence with fasta header fastaHeader1 does not appear to match any reference for organism: multi-ebola-test per `nextclade sort`. Double check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ) ], expected_processed_alignment=ProcessedAlignment( - unalignedNucleotideSequences={ - "ebola-sudan": invalid_sequence(), - }, + unalignedNucleotideSequences={}, alignedNucleotideSequences={}, nucleotideInsertions={}, alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={}, ), ), Case( name="with one failed alignment, one succeeded", input_metadata={}, input_sequence={ - "ebola-sudan": invalid_sequence(), - "ebola-zaire": sequence_with_mutation("ebola-zaire"), + "fastaHeader1": invalid_sequence(), + "fastaHeader2": sequence_with_mutation("ebola-zaire"), }, accession_id="1", expected_metadata={ "totalInsertedNucs_ebola-sudan": None, "totalSnps_ebola-sudan": None, "totalDeletedNucs_ebola-sudan": None, - "length_ebola-sudan": 53, + "length_ebola-sudan": 0, "totalInsertedNucs_ebola-zaire": 0, "totalSnps_ebola-zaire": 1, "totalDeletedNucs_ebola-zaire": 0, @@ -534,15 +550,14 @@ def invalid_sequence() -> str: expected_errors=[], expected_warnings=[ ProcessingAnnotationHelper( - ["ebola-sudan"], - ["ebola-sudan"], - "Nucleotide sequence for ebola-sudan failed to align", + ["alignment"], + ["alignment"], + "Sequence with fasta header fastaHeader1 does not appear to match any reference for organism: multi-ebola-test per `nextclade sort`. Double check you are submitting to the correct organism.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ) ], expected_processed_alignment=ProcessedAlignment( unalignedNucleotideSequences={ - "ebola-sudan": invalid_sequence(), "ebola-zaire": sequence_with_mutation("ebola-zaire"), }, alignedNucleotideSequences={ @@ -554,54 +569,69 @@ def invalid_sequence() -> str: "LEbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "L"), }, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"ebola-zaire": "fastaHeader2"}, ), ), ] segment_validation_tests_single_segment = [ Case( - name="accept any key for single segment", + name="do not accept multiple segments for single segment", input_metadata={}, - input_sequence={"randomKey": sequence_with_mutation("single")}, - accession_id="1", - expected_metadata={ - "completeness": 1.0, - "totalInsertedNucs": 0, - "totalSnps": 1, - "totalDeletedNucs": 0, - "length": len(consensus_sequence("single")), + input_sequence={ + "fastaHeader1": sequence_with_mutation("single"), + "fastaHeader2": sequence_with_mutation("single"), }, - expected_errors=[], + accession_id="2", + expected_metadata={"length": 0}, + expected_errors=[ + ProcessingAnnotationHelper( + [ProcessingAnnotationAlignment], + [ProcessingAnnotationAlignment], + "Multiple sequences: ['fastaHeader1', 'fastaHeader2'] found in the" + " input data, but organism: ebola-sudan-test is single-segmented. " + "Please check that your metadata and sequences are annotated correctly." + "Each metadata entry should have a single corresponding fasta sequence " + "entry with the same submissionId.", + AnnotationSourceType.NUCLEOTIDE_SEQUENCE, + ), + ], expected_warnings=[], expected_processed_alignment=ProcessedAlignment( - unalignedNucleotideSequences={"main": sequence_with_mutation("single")}, - alignedNucleotideSequences={"main": sequence_with_mutation("single")}, + unalignedNucleotideSequences={}, + alignedNucleotideSequences={}, nucleotideInsertions={}, - alignedAminoAcidSequences={ - "NPEbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "NP"), - "VP35EbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "VP35"), - }, + alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={}, ), ), +] + +segment_validation_tests_multi_segments = [ Case( - name="do not accept multiple segments for single segment", + name="don't allow duplicated of the same segment", input_metadata={}, input_sequence={ - "main": sequence_with_mutation("single"), - "randomKey": sequence_with_mutation("single"), + "ebola-sudan": sequence_with_mutation("ebola-sudan"), + "duplicate_ebola-sudan": sequence_with_mutation("ebola-sudan"), + }, + accession_id="1", + expected_metadata={ + "totalInsertedNucs_ebola-sudan": None, + "totalSnps_ebola-sudan": None, + "totalDeletedNucs_ebola-sudan": None, + "length_ebola-sudan": 0, + "totalInsertedNucs_ebola-zaire": None, + "totalSnps_ebola-zaire": None, + "totalDeletedNucs_ebola-zaire": None, + "length_ebola-zaire": 0, }, - accession_id="2", - expected_metadata={"length": 0}, expected_errors=[ ProcessingAnnotationHelper( [ProcessingAnnotationAlignment], [ProcessingAnnotationAlignment], - "Multiple sequences: ['main', 'randomKey'] found in the" - " input data, but organism: ebola-sudan-test is single-segmented. " - "Please check that your metadata and sequences are annotated correctly." - "Each metadata entry should have a single corresponding fasta sequence " - "entry with the same submissionId.", + "Multiple sequences (with fasta headers: duplicate_ebola-sudan, ebola-sudan) align to ebola-sudan - only one entry is allowed.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, ), ], @@ -616,7 +646,7 @@ def invalid_sequence() -> str: ), ] -segment_validation_tests_multi_segments = [ +multi_segment_case_definitions_none_requirement = [ Case( name="accept any prefix for multi-segment", input_metadata={}, @@ -626,13 +656,7 @@ def invalid_sequence() -> str: }, accession_id="1", expected_metadata={ - "totalInsertedNucs_ebola-sudan": 0, - "totalSnps_ebola-sudan": 1, - "totalDeletedNucs_ebola-sudan": 0, "length_ebola-sudan": len(consensus_sequence("ebola-sudan")), - "totalInsertedNucs_ebola-zaire": 0, - "totalSnps_ebola-zaire": 1, - "totalDeletedNucs_ebola-zaire": 0, "length_ebola-zaire": len(consensus_sequence("ebola-zaire")), }, expected_errors=[], @@ -642,18 +666,14 @@ def invalid_sequence() -> str: "ebola-sudan": sequence_with_mutation("ebola-sudan"), "ebola-zaire": sequence_with_mutation("ebola-zaire"), }, - alignedNucleotideSequences={ - "ebola-sudan": sequence_with_mutation("ebola-sudan"), - "ebola-zaire": sequence_with_mutation("ebola-zaire"), - }, + alignedNucleotideSequences={}, nucleotideInsertions={}, - alignedAminoAcidSequences={ - "NPEbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "NP"), - "VP35EbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "VP35"), - "VP24EbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "VP24"), - "LEbolaZaire": ebola_zaire_aa(sequence_with_mutation("ebola-zaire"), "L"), - }, + alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={ + "ebola-sudan": "prefix_ebola-sudan", + "ebola-zaire": "other_prefix_ebola-zaire", + }, ), ), Case( @@ -665,13 +685,7 @@ def invalid_sequence() -> str: }, accession_id="1", expected_metadata={ - "totalInsertedNucs_ebola-sudan": None, - "totalSnps_ebola-sudan": None, - "totalDeletedNucs_ebola-sudan": None, "length_ebola-sudan": 0, - "totalInsertedNucs_ebola-zaire": None, - "totalSnps_ebola-zaire": None, - "totalDeletedNucs_ebola-zaire": None, "length_ebola-zaire": 0, }, expected_errors=[ @@ -682,13 +696,7 @@ def invalid_sequence() -> str: "Each metadata entry can have multiple corresponding fasta sequence " "entries with format _.", AnnotationSourceType.NUCLEOTIDE_SEQUENCE, - ), - ProcessingAnnotationHelper( - [ProcessingAnnotationAlignment], - [ProcessingAnnotationAlignment], - "No segment aligned.", - AnnotationSourceType.NUCLEOTIDE_SEQUENCE, - ), + ) ], expected_warnings=[], expected_processed_alignment=ProcessedAlignment( @@ -697,6 +705,7 @@ def invalid_sequence() -> str: nucleotideInsertions={}, alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={}, ), ), Case( @@ -708,13 +717,7 @@ def invalid_sequence() -> str: }, accession_id="2", expected_metadata={ - "totalInsertedNucs_ebola-sudan": 0, - "totalSnps_ebola-sudan": 1, - "totalDeletedNucs_ebola-sudan": 0, "length_ebola-sudan": len(consensus_sequence("ebola-sudan")), - "totalInsertedNucs_ebola-zaire": None, - "totalSnps_ebola-zaire": None, - "totalDeletedNucs_ebola-zaire": None, "length_ebola-zaire": 0, }, expected_errors=[ @@ -731,13 +734,11 @@ def invalid_sequence() -> str: expected_warnings=[], expected_processed_alignment=ProcessedAlignment( unalignedNucleotideSequences={"ebola-sudan": sequence_with_mutation("ebola-sudan")}, - alignedNucleotideSequences={"ebola-sudan": sequence_with_mutation("ebola-sudan")}, + alignedNucleotideSequences={}, nucleotideInsertions={}, - alignedAminoAcidSequences={ - "NPEbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "NP"), - "VP35EbolaSudan": ebola_sudan_aa(sequence_with_mutation("single"), "VP35"), - }, + alignedAminoAcidSequences={}, aminoAcidInsertions={}, + sequenceNameToFastaHeaderMap={"ebola-sudan": "ebola-sudan"}, ), ), ] @@ -800,6 +801,21 @@ def test_preprocessing_multi_segment_any_requirement(test_case_def: Case): ) +@pytest.mark.parametrize( + "test_case_def", + multi_segment_case_definitions_none_requirement, + ids=lambda tc: f"multi segment not aligned {tc.name}", +) +def test_preprocessing_multi_segment_none_requirement(test_case_def: Case): + config = get_config(MULTI_SEGMENT_CONFIG_UNALIGNED, ignore_args=True) + factory_custom = ProcessedEntryFactory(all_metadata_fields=list(config.processing_spec.keys())) + test_case = test_case_def.create_test_case(factory_custom) + processed_entry = process_single_entry(test_case, config) + verify_processed_entry( + processed_entry.processed_entry, test_case.expected_output, test_case.name + ) + + def test_preprocessing_without_metadata() -> None: config = get_config(MULTI_SEGMENT_CONFIG, ignore_args=True) sequence_entry_data = UnprocessedEntry( diff --git a/preprocessing/specification.md b/preprocessing/specification.md index 00d4ffb645..07532a2f9a 100644 --- a/preprocessing/specification.md +++ b/preprocessing/specification.md @@ -92,6 +92,7 @@ In the NDJSON, each row contains a sequence entry version and a list of errors a nucleotideInsertions, alignedAminoAcidSequences, aminoAcidInsertions, + sequenceNameToFastaHeaderMap, //TODO: use in backend files } } diff --git a/website/src/components/Edit/SequencesForm.spec.tsx b/website/src/components/Edit/SequencesForm.spec.tsx index 0e1fd51b3a..3428287115 100644 --- a/website/src/components/Edit/SequencesForm.spec.tsx +++ b/website/src/components/Edit/SequencesForm.spec.tsx @@ -62,7 +62,7 @@ describe('SequencesForm', () => { expect(fasta).not.toBeUndefined(); const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId_Segment1\nATCG'); - expect(editableSequences.getSequenceRecord()).deep.equals({ 'Segment 1': 'ATCG' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId_Segment1: 'ATCG' }); const rows = editableSequences.rows; expect(rows).toEqual([ @@ -84,7 +84,7 @@ describe('SequencesForm', () => { expect(fasta).not.toBeUndefined(); const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId_Segment1\nATCG'); - expect(editableSequences.getSequenceRecord()).deep.equals({ 'Segment 1': 'ATCG' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId_Segment1: 'ATCG' }); const rows = editableSequences.rows; expect(rows).toEqual([ @@ -117,7 +117,7 @@ describe('SequencesForm', () => { expect(fasta).not.toBeUndefined(); const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId_Segment1\nATCG'); - expect(editableSequences.getSequenceRecord()).deep.equals({ 'Segment 1': 'ATCG' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId_Segment1: 'ATCG' }); const rows = editableSequences.rows; expect(rows).toEqual([ @@ -133,7 +133,7 @@ describe('SequencesForm', () => { expect(fasta).not.toBeUndefined(); const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId_Segment1\nATCG\n>subId_Segment2\nTT'); - expect(editableSequences.getSequenceRecord()).deep.equals({ 'Segment 1': 'ATCG', 'Segment 2': 'TT' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId_Segment1: 'ATCG', subId_Segment2: 'TT' }); const rows = editableSequences.rows; expect(rows).deep.equals([ @@ -189,7 +189,7 @@ describe('SequencesForm', () => { const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId\nATCG'); - expect(editableSequences.getSequenceRecord()).deep.equals({ [key]: 'ATCG' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId: 'ATCG' }); const rows = editableSequences.rows; expect(rows).deep.equals([{ label: key, value: 'ATCG', initialValue: null, fastaHeader: 'subId', key }]); @@ -229,7 +229,7 @@ describe('SequencesForm', () => { const fastaText = await fasta!.text(); expect.soft(fastaText).toBe('>subId_label\nATCG'); - expect(editableSequences.getSequenceRecord()).deep.equals({ label: 'ATCG' }); + expect(editableSequences.getSequenceRecord()).deep.equals({ subId_label: 'ATCG' }); }); test('GIVEN initial segment data that is then deleted as an edit THEN the edit record does not contain the segment key but input field is kept', () => { @@ -240,7 +240,7 @@ describe('SequencesForm', () => { expect(editableSequences.rows).toEqual([ { - label: 'originalFastaHeader', + label: 'originalFastaHeader (mapped to unalignedProcessedSequenceName)', fastaHeader: 'originalFastaHeader', value: 'originalUnalignedNucleotideSequencesValue', initialValue: 'originalUnalignedNucleotideSequencesValue', diff --git a/website/src/components/Edit/SequencesForm.tsx b/website/src/components/Edit/SequencesForm.tsx index 7378bb11ff..b404e963f5 100644 --- a/website/src/components/Edit/SequencesForm.tsx +++ b/website/src/components/Edit/SequencesForm.tsx @@ -61,6 +61,18 @@ export class EditableSequences { return this.maxNumberOfRows > 1; } + static invertRecordMulti(obj: Record): Record { + const inverted: Record = {}; + + for (const key in obj) { + const value = obj[key]; + if (value === null) continue; + (inverted[value] ??= []).push(key); + } + + return inverted; + } + /** * @param initialData The sequence entry to edit, from which the initial sequence data is taken. * @param referenceGenomeLightweightSchema @@ -70,16 +82,27 @@ export class EditableSequences { referenceGenomeLightweightSchema: ReferenceGenomesLightweightSchema, ): EditableSequences { const maxNumberRows = this.getMaxNumberOfRows(referenceGenomeLightweightSchema); + const fastaHeaderMap = EditableSequences.invertRecordMulti( + initialData.processedData.sequenceNameToFastaHeaderMap, + ); const existingDataRows = Object.entries(initialData.originalData.unalignedNucleotideSequences).map( - ([key, value]) => ({ - // TODO: older entries will still have the segmentName and not the fastaHeader as a key - label: key, // TODO: In future prepro will map the fastaHeader to the segment (will be added to the label) - fastaHeader: key, - value: value, - initialValue: value, - key: EditableSequences.getNextKey(), - }), + ([key, value]) => { + const mapped = (fastaHeaderMap[key] ?? []).join(', ') || ''; + const label = !mapped + ? `${key} (could not be classified)` + : mapped === key + ? key + : `${key} (mapped to ${mapped})`; + return { + label, + fastaHeader: maxNumberRows > 1 ? key : initialData.submissionId, + value: value, + initialValue: value, + key: EditableSequences.getNextKey(), + }; + }, ); + return new EditableSequences(existingDataRows, maxNumberRows); } @@ -138,7 +161,7 @@ export class EditableSequences { getFastaIds(): string { const filledRows = this.rows.filter((row) => row.value !== null); - return filledRows.map((sequence) => sequence.label?.replace(/\s+/g, '')).join(', '); + return filledRows.map((sequence) => sequence.fastaHeader).join(','); } getSequenceFasta(): File | undefined { @@ -165,7 +188,7 @@ export class EditableSequences { ); return filledRows.reduce>((prev, row) => { - prev[row.label] = row.value; //TODO: this will have to be changed to fastaHeader in future + prev[row.fastaHeader] = row.value; return prev; }, {}); } diff --git a/website/src/components/ReviewPage/SequencesDialog.spec.tsx b/website/src/components/ReviewPage/SequencesDialog.spec.tsx index 5f106af900..98abed902a 100644 --- a/website/src/components/ReviewPage/SequencesDialog.spec.tsx +++ b/website/src/components/ReviewPage/SequencesDialog.spec.tsx @@ -93,6 +93,10 @@ const dataToView: SequenceEntryToEdit = { }, nucleotideInsertions: {}, aminoAcidInsertions: {}, + sequenceNameToFastaHeaderMap: { + [sequence1]: 'header1', + [sequence2]: 'header2', + }, files: null, }, status: processedStatus, diff --git a/website/src/components/Submission/FileUpload/SequenceEntryUploadComponent.tsx b/website/src/components/Submission/FileUpload/SequenceEntryUploadComponent.tsx index 4d560a85ab..c2e94f12bf 100644 --- a/website/src/components/Submission/FileUpload/SequenceEntryUploadComponent.tsx +++ b/website/src/components/Submission/FileUpload/SequenceEntryUploadComponent.tsx @@ -9,7 +9,6 @@ import { ColumnMappingModal } from './ColumnMappingModal'; import { FileUploadComponent } from './FileUploadComponent'; import { FASTA_FILE_KIND, METADATA_FILE_KIND, RawFile, type ProcessedFile } from './fileProcessing'; import type { InputField } from '../../../types/config'; -import { getFirstLightweightSchema, type ReferenceGenomesLightweightSchema } from '../../../types/referencesGenomes'; import { dataUploadDocsUrl } from '../dataUploadDocsUrl'; type SequenceEntryUploadProps = { @@ -21,7 +20,6 @@ type SequenceEntryUploadProps = { setSequenceFile: Dispatch>; columnMapping: ColumnMapping | null; setColumnMapping: Dispatch>; - referenceGenomeLightweightSchema: ReferenceGenomesLightweightSchema; metadataTemplateFields: Map; enableConsensusSequences: boolean; isMultiSegmented: boolean; @@ -39,7 +37,6 @@ export const SequenceEntryUpload: FC = ({ setSequenceFile, columnMapping, setColumnMapping, - referenceGenomeLightweightSchema, metadataTemplateFields, enableConsensusSequences, isMultiSegmented, @@ -98,23 +95,9 @@ export const SequenceEntryUpload: FC = ({ {isMultiSegmented && (

{organism.toUpperCase()} has a multi-segmented genome. Please submit one metadata entry with a - unique submissionId for the full multi-segmented sample, e.g. sample1. Sequence - data should be a FASTA file with each header indicating the submissionId and the segment, - i.e.{' '} - {getFirstLightweightSchema(referenceGenomeLightweightSchema).nucleotideSegmentNames.map( - (name, index) => ( - - sample1_{name} - {index !== - getFirstLightweightSchema(referenceGenomeLightweightSchema).nucleotideSegmentNames - .length - - 1 - ? ', ' - : ''} - - ), - )} - . + unique submissionId column for the full multi-segmented sample, e.g. sample1 and a{' '} + fastaId column with a space-separated list of the fasta headers of all segments, e.g.{' '} + fastaHeaderSegment1 fastaHeaderSegment2 fastaHeaderSegment3.

)} diff --git a/website/src/components/Submission/FormOrUploadWrapper.tsx b/website/src/components/Submission/FormOrUploadWrapper.tsx index 672065bbdc..5c044f60e4 100644 --- a/website/src/components/Submission/FormOrUploadWrapper.tsx +++ b/website/src/components/Submission/FormOrUploadWrapper.tsx @@ -138,7 +138,6 @@ export const FormOrUploadWrapper: FC = ({ setSequenceFile={setSequenceFile} columnMapping={columnMapping} setColumnMapping={setColumnMapping} - referenceGenomeLightweightSchema={referenceGenomeLightweightSchema} metadataTemplateFields={metadataTemplateFields} enableConsensusSequences={enableConsensusSequences} isMultiSegmented={isMultiSegmented} diff --git a/website/src/types/backend.ts b/website/src/types/backend.ts index 20b69f7c89..21310175e6 100644 --- a/website/src/types/backend.ts +++ b/website/src/types/backend.ts @@ -234,6 +234,7 @@ export const sequenceEntryToEdit = accessionVersion.merge( nucleotideInsertions: z.record(z.array(z.string())), alignedAminoAcidSequences: z.record(z.string().nullable()), aminoAcidInsertions: z.record(z.array(z.string())), + sequenceNameToFastaHeaderMap: z.record(z.string().nullable()), files: filesByCategory.nullable(), }), }), diff --git a/website/vitest.setup.ts b/website/vitest.setup.ts index 9818f7ce59..ff28ccff4b 100755 --- a/website/vitest.setup.ts +++ b/website/vitest.setup.ts @@ -119,6 +119,9 @@ export const defaultReviewData: SequenceEntryToEdit = { aminoAcidInsertions: { processedInsertionGeneName: ['aminoAcidInsertion1', 'aminoAcidInsertion2'], }, + sequenceNameToFastaHeaderMap: { + unalignedProcessedSequenceName: 'originalFastaHeader', + }, files: null, }, submissionId: 'defaultSubmitter',