Alternatives and similar repositories for LLM4Drug

Users that are interested in LLM4Drug are comparing it to the libraries listed below

• jiaxianyan / DeltaDock
  ☆27Updated last year
• iipharma / transpharmer-repo
  ☆40Updated 7 months ago
• luost26 / ChemProjector
  Projecting Molecules into Synthesizable Chemical Spaces (ICML 2024)
  ☆52Updated 2 weeks ago
• OdinZhang / AI-Physics-DrugDiscovery
  my own studied materials and scripts
  ☆54Updated 2 weeks ago
• bytedance / DecompOpt
  ☆15Updated last year
• CMACH508 / KGDiff
  Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance
  ☆35Updated last year
• OdinZhang / ResGen
  3D_Molecular_Generation
  ☆100Updated 11 months ago
• zaixizhang / DrugGPS_ICML23
  Implementation of ICML23 paper "Learning Subpocket Prototypes for Generalizable Structure-based Drug Design"
  ☆30Updated last year
• wzxxxx / Substructure-Mask-Explanation
  structure-based explanation methods
  ☆28Updated last year
• ashipiling / GPT_3DSMILES
  ☆31Updated 2 months ago
• zaixizhang / FLAG
  Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"
  ☆69Updated last year
• WangZiXubiubiu / SketchMol-v1
  Official implementation of SketchMol.
  ☆30Updated 8 months ago
• jkwang93 / Token-Mol
  Token-Mol 1.0：tokenized drug design with large language model
  ☆55Updated 2 weeks ago
• OdinZhang / SurfGen
  SurfGen: Learning on Topological Surface and Geometric Structure for 3D Molecular Generation
  ☆70Updated 11 months ago
• youqingxiaozhua / DeepTernary
  ☆37Updated 3 months ago
• myprecioushh / ZeroBind
  ☆26Updated last year
• qiangbo1222 / Uni-RXN-official
  ☆28Updated last year
• jiaxianyan / BioMiner
  A Multi-modal System for Automated Mining of Protein-Ligand Bioactivity Data from Literature
  ☆60Updated 3 months ago
• coleygroup / shepherd
  Training and inference code for ShEPhERD: Diffusing shape, electrostatics, and pharmacophores for bioisosteric drug design [ICLR 2025 ora…
  ☆81Updated last month
• zhaisilong / awesome-peptide
  List of papers about Peptide research using Deep Learning
  ☆31Updated 2 weeks ago
• THGLab / LP-PDBBind
  ☆57Updated 3 months ago
• stonewiseAIDrugDesign / Lingo3DMol
  ☆59Updated last year
• Brian-hongyan / 3D-MCTS
  3D-MCTS: A general structure-based molecule generation method with MCTS.
  ☆44Updated last year
• SigmaGenX / TamGen
  ☆38Updated 4 months ago
• OdinZhang / FragGen
  This Code is for Fragment-wise 3D Structure-based Molecular Generation with Reliable Geometry
  ☆28Updated 7 months ago
• CataAI / PoseX
  PoseX: A Molecular Docking Benchmark
  ☆52Updated 3 months ago
• VicFisher / DiffPhore
  Knowledge-Guided Diffusion Model for 3D Ligand-Pharmacophore Mapping
  ☆42Updated 4 months ago
• tsa87 / tacogfn
  [TMLR 24'] TacoGFN: Target Conditioned GFlowNet for Structure-based Drug Design
  ☆13Updated 3 months ago
• Genentech / Voxbind
  ☆27Updated last year
• ZhiGroup / FDA
  Folding-Docking-Affinity framework for protein-ligand affinity prediction
  ☆27Updated 7 months ago