|
11 | 11 | </a> |
12 | 12 | </p> |
13 | 13 |
|
14 | | - |
| 14 | +[](https://doi.org/10.21105/joss.08341) |
15 | 15 | [](https://pypi.org/project/ChemInformant/) |
16 | 16 | [](https://pypi.org/project/ChemInformant/) |
17 | 17 | [](https://github.com/HzaCode/ChemInformant/actions/workflows/tests.yml) |
18 | 18 |  |
19 | 19 | [](https://github.com/psf/black) |
20 | 20 | [](https://github.com/HzaCode/ChemInformant/blob/main/LICENSE.md) |
21 | 21 | [](https://hezhiang.com/ChemInformant)[](https://app.codacy.com/gh/HzaCode/ChemInformant/dashboard?utm_source=gh&utm_medium=referral&utm_content=&utm_campaign=Badge_grade) |
22 | | -[](https://doi.org/10.5281/zenodo.16623785) |
| 22 | + |
23 | 23 |
|
24 | 24 | **ChemInformant** is a robust data acquisition engine for the [PubChem](https://pubchem.ncbi.nlm.nih.gov/) database, engineered for the modern scientific workflow. It intelligently manages network requests, performs rigorous runtime data validation, and delivers analysis-ready results, providing a dependable foundation for any computational chemistry project in Python. |
25 | 25 |
|
@@ -158,14 +158,17 @@ This project is licensed under the MIT License - see the [LICENSE](LICENSE.md) f |
158 | 158 | ### 📑 Citation |
159 | 159 |
|
160 | 160 | ```bibtex |
161 | | -@software{ChemInformant, |
162 | | - title = {ChemInformant}, |
163 | | - author = {He, Zhiang}, |
| 161 | +@article{He2025, |
| 162 | + doi = {10.21105/joss.08341}, |
| 163 | + url = {https://doi.org/10.21105/joss.08341}, |
164 | 164 | year = {2025}, |
165 | | - version = {2.4.0}, |
166 | | - publisher = {Zenodo}, |
167 | | - doi = {10.5281/zenodo.16623785}, |
168 | | - url = {https://doi.org/10.5281/zenodo.16623785}, |
169 | | - note = {Software} |
| 165 | + publisher = {The Open Journal}, |
| 166 | + volume = {10}, |
| 167 | + number = {112}, |
| 168 | + pages = {8341}, |
| 169 | + author = {He, Zhiang}, |
| 170 | + title = {ChemInformant: A Robust and Workflow-Centric Python Client for High-Throughput PubChem Access}, |
| 171 | + journal = {Journal of Open Source Software} |
170 | 172 | } |
| 173 | +
|
171 | 174 | ``` |
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