Alternatives and similar repositories for DualDiff

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

• kxz18 / UniMoMo
  Codes for our paper "UniMoMo: Unified Generative Modeling of 3D Molecules for De Novo Binder Design" (ICML 2025)
  ☆77Updated last month
• CMACH508 / KGDiff
  Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance
  ☆35Updated last year
• zaixizhang / Awesome-SBDD
  Papers about Structure-based Drug Design (SBDD)
  ☆138Updated 4 months ago
• bytedance / DecompOpt
  ☆16Updated last year
• OdinZhang / ResGen
  3D_Molecular_Generation
  ☆103Updated last year
• Layne-Huang / PMDM
  ☆144Updated 5 months ago
• pengxingang / PocketXMol
  Implementation of PocketXMol, the pocket-interacting molecular generative foundation model.
  ☆100Updated last week
• ACE-KAIST / DeepICL
  Official Github for "3D Molecular Generative Framework for Interaction-guided Drug Design" (Nature Communications)
  ☆65Updated last year
• YangLing0818 / IPDiff
  [ICLR 2024] Protein-Ligand Interaction Prior for Binding-aware 3D Molecule Diffusion Models
  ☆53Updated last year
• pengxingang / MolDiff
  MolDiff: Addressing the Atom-Bond Inconsistency Problem in 3D Molecule Diffusion Generation
  ☆79Updated last year
• wengong-jin / DSMBind
  ☆97Updated last year
• OdinZhang / SurfGen
  SurfGen: Learning on Topological Surface and Geometric Structure for 3D Molecular Generation
  ☆70Updated last year
• THGLab / LP-PDBBind
  ☆58Updated 5 months ago
• schrojunzhang / KarmaDock
  ☆130Updated last year
• JocelynSong / SurfPro
  ☆34Updated 9 months ago
• jkwang93 / Token-Mol
  Token-Mol 1.0：tokenized drug design with large language model
  ☆60Updated last month
• zaixizhang / DrugGPS_ICML23
  Implementation of ICML23 paper "Learning Subpocket Prototypes for Generalizable Structure-based Drug Design"
  ☆30Updated last year
• GenSI-THUAIR / MolCRAFT
  Official repository for MolCRAFT series
  ☆135Updated 2 months ago
• Ced3-han / PepFlowww
  Full-Atom Peptide Design based on Multi-modal Flow Matching (ICML 2024)
  ☆100Updated 7 months ago
• guaguabujianle / EHIGN_PLA
  ☆21Updated last year
• THUNLP-MT / PepGLAD
  Codes for our paper "Full-Atom Peptide Design with Geometric Latent Diffusion" (NeurIPS 2024)
  ☆103Updated 8 months ago
• biomed-AI / Diffleop
  ☆10Updated 10 months ago
• MoleculeAI / TAGMol
  TAGMol: Target-Aware Gradient-guided Molecule Generation (ICML'24 ML4LMS Workshop)
  ☆12Updated last year
• bowen-gao / DrugCLIP
  [NeurIPS 2023] DrugCLIP: Contrastive Protein-Molecule Representation Learning for Virtual Screening
  ☆122Updated last month
• sc8668 / GenScore
  ☆40Updated last year
• guanjq / LinkerNet
  The official implementation of LinkerNet: Fragment Poses and Linker Co-Design with 3D Equivariant Diffusion (NeurIPS 2023 Spotlight)
  ☆15Updated last year
• MinkaiXu / AliDiff
  NeurIPS24: Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization
  ☆41Updated 9 months ago
• stonewiseAIDrugDesign / Lingo3DMol
  ☆61Updated 2 years ago
• recursionpharma / synflownet-boltz
  ☆57Updated 6 months ago
• cch1999 / posecheck
  Pose checks for 3D Structure-based Drug Design methods
  ☆92Updated last year