Alternatives and similar repositories for Modof

Users that are interested in Modof are comparing it to the libraries listed below

• Brian-hongyan / 3D-MCTS
  3D-MCTS: A general structure-based molecule generation method with MCTS.
  ☆44Updated last year
• zjujdj / InteractionGraphNet
  InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…
  ☆47Updated 2 years ago
• ninglab / Modof
  The implementation of Modof for Molecule Optimization
  ☆30Updated 2 years ago
• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆64Updated last year
• jaechanglim / GGM
  graph generative model for molecule
  ☆40Updated 5 years ago
• HelloJocelynLu / EFGs
  A simple molecule fragmentation method.
  ☆37Updated 2 years ago
• keiradams / SQUID
  Official implementation of "Equivariant Shape-Conditioned Generation of 3D Molecules for Ligand-Based Drug Design"
  ☆67Updated 10 months ago
• oxpig / DEVELOP
  ☆55Updated last year
• micahwang / RELATION
  ☆17Updated 2 years ago
• coleygroup / Graph2SMILES
  ☆63Updated last year
• DrugAI / ACNet
  ☆16Updated 3 years ago
• wzxxxx / MGA
  MGA
  ☆44Updated 4 years ago
• deep-scaffold / deep_scaffold
  ☆25Updated 5 years ago
• anny0316 / GEOM-CVAE
  ☆15Updated 4 years ago
• zaixizhang / DrugGPS_ICML23
  Implementation of ICML23 paper "Learning Subpocket Prototypes for Generalizable Structure-based Drug Design"
  ☆30Updated last year
• abdulsalam-bande / KDeep
  Implementation of the Kdeep Paper
  ☆21Updated 4 years ago
• MolecularAI / Lib-INVENT
  ☆58Updated 2 years ago
• Chokyotager / NotYetAnotherNightshade
  Graph variational encoders for drug engineering and potentiation
  ☆30Updated 2 years ago
• OdinZhang / SDEGen
  ☆24Updated 2 years ago
• luost26 / ChemProjector
  Projecting Molecules into Synthesizable Chemical Spaces (ICML 2024)
  ☆52Updated last week
• MolecularAI / Lib-INVENT-dataset
  ☆21Updated 2 years ago
• jkwang93 / ChemistGA
  ☆23Updated 3 years ago
• YinanHuang / 3DLinker
  An E(3) Equivariant Variational Autoencoder for Molecular Linker Design
  ☆49Updated 3 years ago
• stonewiseAIDrugDesign / Lingo3DMol
  ☆58Updated last year
• linminhtoo / neuralsym
  Reimplementation of Segler et al's Template Relevance Network (NeuralSym) in their seminal Nature publication
  ☆33Updated 3 years ago
• bigchem / synthesis
  Contains results and data from Augmented Transformer article
  ☆39Updated 5 years ago
• j9650 / MedusaGraph
  ☆28Updated 3 years ago
• drorlab / combind
  Integrated physics-based and ligand-based modeling.
  ☆64Updated this week
• Xundrug / MolGpKa
  The graph-convolutional neural network for pka prediction
  ☆89Updated last year
• pfizer-opensource / transform-molecules
  ☆17Updated 2 years ago