Popular repositories Loading

1. molgpt molgpt Public

   Python 134 46

2. DeepPocket DeepPocket Public

   Ligand Binding Site detection using Deep Learning

   Python 94 27

3. CIGIN CIGIN Public

   AAAI 2020: Chemically Interpretable Graph Interaction Network for Prediction of Pharmacokinetic Properties of Drug-like Molecules

   Jupyter Notebook 35 19

4. MoleGuLAR MoleGuLAR Public

   Repository for MoleGuLAR: Molecule generation using Reinforcement Learning and Alternating Rewards

   Jupyter Notebook 23 7

5. BAND-NN BAND-NN Public

   J. Comp. Chem. 2020, 41, 790-799

   Python 10 2

6. SCONES SCONES Public

   Self-Consistent Neural Network for Protein Stability Prediction upon Mutations

   Python 10 3