Alternatives and similar repositories for Modof

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

• micahwang / RELATION
  ☆17Updated 3 years ago
• jaechanglim / GGM
  graph generative model for molecule
  ☆40Updated 6 years ago
• Brian-hongyan / 3D-MCTS
  3D-MCTS: A general structure-based molecule generation method with MCTS.
  ☆45Updated last year
• oxpig / DEVELOP
  ☆57Updated last year
• MolecularAI / Lib-INVENT-dataset
  ☆22Updated 2 years ago
• j9650 / MedusaGraph
  ☆28Updated 3 years ago
• OdinZhang / SDEGen
  ☆24Updated 2 years ago
• ninglab / Modof
  The implementation of Modof for Molecule Optimization
  ☆32Updated 2 years ago
• DirectMolecularConfGen / DMCG
  ☆63Updated 3 years ago
• DrugAI / ACNet
  ☆17Updated 3 years ago
• Shihang-Wang-58 / DeepSA
  A Deep-learning Driven Predictor of Compound Synthesis Accessibility
  ☆40Updated 8 months ago
• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆68Updated 2 years ago
• zjujdj / InteractionGraphNet
  InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…
  ☆47Updated 2 years ago
• abdulsalam-bande / KDeep
  Implementation of the Kdeep Paper
  ☆21Updated 4 years ago
• keiradams / SQUID
  Official implementation of "Equivariant Shape-Conditioned Generation of 3D Molecules for Ligand-Based Drug Design"
  ☆68Updated last year
• m-mokaya / RIOP
  ☆18Updated 2 years ago
• longlongman / DESERT
  Zero-Shot 3D Drug Design by Sketching and Generating (NeurIPS 2022)
  ☆35Updated 3 years ago
• jkwang93 / ChemistGA
  ☆22Updated 3 years ago
• HelloJocelynLu / EFGs
  A simple molecule fragmentation method.
  ☆41Updated 2 years ago
• YinanHuang / 3DLinker
  An E(3) Equivariant Variational Autoencoder for Molecular Linker Design
  ☆51Updated 3 years ago
• MatthewMasters / EDM-Dock
  ☆32Updated 2 years ago
• MolecularAI / Lib-INVENT
  ☆64Updated 2 years ago
• jaechanglim / DTI_PDBbind
  ☆34Updated 3 years ago
• Genentech / Voxbind
  ☆32Updated last year
• THGLab / LP-PDBBind
  ☆61Updated 6 months ago
• juanniwu / t-SMILES
  ☆39Updated 9 months ago
• zaixizhang / DrugGPS_ICML23
  Implementation of ICML23 paper "Learning Subpocket Prototypes for Generalizable Structure-based Drug Design"
  ☆30Updated last year
• illidanlab / MolSearch
  Implementation of MolSearch paper
  ☆23Updated 2 years ago
• CMACH508 / KGDiff
  Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance
  ☆35Updated 2 years ago
• coleygroup / shepherd
  Training and inference code for ShEPhERD: Diffusing shape, electrostatics, and pharmacophores for bioisosteric drug design [ICLR 2025 ora…
  ☆86Updated last week