| Name | Version | Summary | date |
| solphedge |
0.0.4.post3 |
pH-dependent solubility predictions for small molecules |
2025-07-09 21:35:32 |
| molactivity |
3.0 |
Molecular activity prediction using transformer neural networks with 5 operational modes |
2025-07-08 10:37:02 |
| Mold2-pywrapper |
0.1.2 |
Python wrapper for Mold2 descriptors |
2024-11-06 07:24:01 |
| papyrus-scripts |
2.1.1 |
A collection of scripts to handle the Papyrus bioactivity dataset |
2024-11-04 18:42:36 |
| peptides |
0.3.4 |
Physicochemical properties, indices and descriptors for amino-acid sequences. |
2024-09-09 11:51:45 |
| MoleculaPy |
1.1.3 |
A command-line application that utilizes the RDKit library to compute molecular descriptors and fingerprints, aiding in the analysis and characterization of chemical structures |
2024-09-07 13:40:02 |
| BlueDesc-pywrapper |
0.0.5.post1 |
Python wrapper for BlueDesc molecular descriptors |
2024-05-17 19:37:10 |
| chemopy2 |
1.0.5 |
"A Python library calculating molecular descriptors." |
2024-05-10 20:50:16 |