PyDigger - unearthing stuff about Python


NameVersionSummarydate
biocatalyzer 0.1.2b0 BioCatalyzer: a rule-based tool to predict compound metabolism 2025-02-12 10:42:44
scikit-fingerprints 1.13.0 Library for effective molecular fingerprints calculation 2025-01-31 15:12:11
chem-ant 0.1.2 Select materials to output molecules similar to the target molecule with MCTS Solver and Genetic Programming. 2024-11-02 11:24:43
conphar 0.1.2 ConPhar 2024-09-25 09:07:16
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
bemm-gen 2024.7.26 Biomolecular Environment Mimicking Model GENerator 2024-07-26 01:56:10
cemm-gen 2024.7.23 Cellular Environment Mimicking Model GENerator 2024-07-22 07:34:53
moldrug 3.7.3 moldrug is a python package for drug-oriented optimization on the chemical space. 2024-07-05 15:28:13
qsarKit 0.0.1 A Python package that offers robust predictive modeling using QSAR for evaluating the transfer of environmental contaminants in breast milk. It integrates multiple predictive models, provides synthetic data generation via GANs, and is tailored for researchers and health professionals. 2024-05-08 15:53:39
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