Alternatives and similar repositories for GLAM

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

• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆63Updated last year
• ziqi92 / Modof
  Molecule Optimization via Fragment-based Generative Models
  ☆42Updated 2 years ago
• wzxxxx / MGA
  MGA
  ☆44Updated 4 years ago
• zjujdj / InteractionGraphNet
  InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…
  ☆46Updated 2 years ago
• smiles724 / ProtMD
  ☆64Updated 2 months ago
• admislf / MINN-DTI
  Effective drug-target interaction prediction with mutual interaction neural network
  ☆33Updated 3 years ago
• OdinZhang / ResGen
  3D_Molecular_Generation
  ☆99Updated 9 months ago
• anny0316 / GEOM-CVAE
  ☆15Updated 4 years ago
• guaguabujianle / GIGN
  ☆45Updated 2 years ago
• oxpig / DEVELOP
  ☆55Updated last year
• j9650 / MedusaGraph
  ☆28Updated 3 years ago
• zchwang / DeepRMSD-Vina_Optimization
  DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.
  ☆42Updated last year
• coleygroup / Graph2SMILES
  ☆59Updated last year
• linminhtoo / neuralsym
  Reimplementation of Segler et al's Template Relevance Network (NeuralSym) in their seminal Nature publication
  ☆33Updated 2 years ago
• jkwang93 / ChemistGA
  ☆23Updated 2 years ago
• zaixizhang / FLAG
  Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"
  ☆69Updated last year
• CMACH508 / KGDiff
  Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance
  ☆34Updated last year
• Brian-hongyan / 3D-MCTS
  3D-MCTS: A general structure-based molecule generation method with MCTS.
  ☆43Updated last year
• conghaowang / GLDM
  ☆19Updated 8 months ago
• Xundrug / MolGpKa
  The graph-convolutional neural network for pka prediction
  ☆82Updated last year
• stonewiseAIDrugDesign / Lingo3DMol
  ☆58Updated last year
• DirectMolecularConfGen / DMCG
  ☆58Updated 2 years ago
• OdinZhang / AI-Physics-DrugDiscovery
  my own studied materials and scripts
  ☆52Updated 4 months ago
• OdinZhang / SDEGen
  ☆23Updated 2 years ago
• Chokyotager / NotYetAnotherNightshade
  Graph variational encoders for drug engineering and potentiation
  ☆30Updated 2 years ago
• OdinZhang / SurfGen
  SurfGen: Learning on Topological Surface and Geometric Structure for 3D Molecular Generation
  ☆69Updated 9 months ago
• bytedance / markov-molecular-sampling
  ☆57Updated 3 years ago
• lmqfly / Geometry-Deep-Learning-for-Drug-Discovery
  Geometry Deep Learning for Drug Discovery and Life Science
  ☆71Updated last year
• EBjerrum / molvecgen
  Molecular vectorization and batch generation
  ☆50Updated 4 years ago
• sc8668 / RTMScore
  ☆105Updated 2 years ago