Drugai
Generation and Classification of Drug Like molecule usings Neural Networks
| Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
|---|---|---|---|---|---|---|---|---|---|---|
| Dgl Lifesci | 558 |  | 4 | a year ago | 17 | December 21, 2022 | 25 | apache-2.0 | Python | |
| Python package for graph neural networks in chemistry and biology | ||||||||||
| Graphinvent | 312 | a year ago | 10 | mit | Python | |||||
| Graph neural networks for molecular design. | ||||||||||
| Tensormol | 190 | 6 years ago | 1 | November 08, 2017 | 16 | gpl-3.0 | Python | |||
| Tensorflow + Molecules = TensorMol | ||||||||||
| Moleculargnn_smiles | 182 | 3 years ago | 5 | apache-2.0 | Python | |||||
| The code of a graph neural network (GNN) for molecules, which is based on learning representations of r-radius subgraphs (i.e., fingerprints) in molecules. | ||||||||||
| Neuralogic | 84 | 4 months ago | 2 | February 23, 2022 | mit | Java | ||||
| Deep relational learning through differentiable logic programming. | ||||||||||
| Deep Drug Coder | 75 | 3 years ago | 1 | mit | Python | |||||
| A tensorflow.keras generative neural network for de novo drug design, published in Nature Machine Intelligence while working at AstraZeneca. | ||||||||||
| Drugai | 56 | 5 years ago | Python | |||||||
| Generation and Classification of Drug Like molecule usings Neural Networks | ||||||||||
| Sars Cov Inhibitors Chemai | 36 | 4 years ago | mit | |||||||
| Large-scale ligand-based virtual screening for potential SARS-Cov-2 inhibitors using a deep neural network | ||||||||||
| Aimnet | 31 | 4 years ago | 3 | mit | Python | |||||
| Atoms In Molecules Neural Network Potential | ||||||||||
| Hierarchical Molecular Learning | 11 | 6 years ago | mit | Python | ||||||
| Implementation of "Semi-supervised learning of hierarchical representations of molecules using neural message passing" (arXiv:1711.10168) | ||||||||||
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