Popular repositories Loading

1. Molecular_Dynamics_and_Free_Energy_Perturbation Molecular_Dynamics_and_Free_Energy_Perturbation Public

   Molecular Dynamics and Free Energy Perturbation

   Python 1

2. guacamol guacamol Public

   Forked from BenevolentAI/guacamol

   Benchmarks for generative chemistry

   Python

3. guacamol_baselines guacamol_baselines Public

   Forked from BenevolentAI/guacamol_baselines

   Baselines models for GuacaMol benchmarks

   Python

4. DeeplyTough DeeplyTough Public

   Forked from BenevolentAI/DeeplyTough

   Python

5. deepchem deepchem Public

   Forked from deepchem/deepchem

   Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

   Python

6. GENTRL GENTRL Public

   Forked from insilicomedicine/GENTRL

   Generative Tensorial Reinforcement Learning (GENTRL) model

   Python