Similar repositories to reymond-group/MAP4-Chemical-Space-of-NPAtlas:

• reymond-group/MAP4-Chemical-Space-of-NPAtlas github similar
• jeah-z/Generative_Models_benchmark_gdb13 github similar
• dockstring/dockstring github similar
• PatWalters/workshop github similar
• rxn4chemistry/rxn4chemistry github similar
• hesther/espsim github similar
• openmm/openmmforcefields github similar
• pcko1/Deep-Drug-Coder github similar
• wengong-jin/hgraph2graph github similar
• MolecularAI/aizynthfinder github similar
• aiqm/torchani github similar
• wengong-jin/icml18-jtnn github similar
• aspuru-guzik-group/selfies github similar
• e3nn/e3nn github similar
• molecularsets/moses github similar
• lmmentel/awesome-python-chemistry github similar
• chemprop/chemprop github similar
• rdkit/rdkit github similar
• deepmind/deepmind-research github similar
• rusty1s/pytorch_geometric github similar
• pyg-team/pytorch_geometric github similar