| Name | Version | Summary | date |
| MASSA-Algorithm |
0.9.6 |
MASSA Algorithm is a Python package to separate data sets of molecules into training and test sets, considering the diversity of structural, physicochemical and biological characteristics of these molecules. |
2024-12-04 19:52:52 |
| chemicalchecker |
1.0.6 |
Chemical Checker Package. |
2024-11-26 18:33:47 |
| signaturizer |
1.1.15 |
Generate Chemical Checker signatures from molecules SMILES. |
2024-05-23 18:54:20 |
| prolif |
2.0.2 |
Interaction Fingerprints for protein-ligand complexes and more |
2024-03-06 23:38:18 |
| moll |
0.1.12 |
|
2024-02-11 16:42:44 |
| chemprice |
1.1.0 |
A python library for chemical price Search. |
2024-01-10 01:37:39 |
| bokehmol |
0.1.0a3 |
Tools for plotting molecules in Bokeh |
2023-07-20 23:22:40 |
| global-chem-extensions |
1.0.3 |
|
2022-09-03 14:35:44 |
| mordred |
1.2.0 |
molecular descriptor calculator |
2019-06-05 18:20:01 |