Alternatives and similar repositories for DeepCDA

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

• admislf / MINN-DTI
  Effective drug-target interaction prediction with mutual interaction neural network
  ☆33Updated 3 years ago
• j9650 / MedusaGraph
  ☆28Updated 3 years ago
• sun-heqi / MultiPPIMI
  A deep learning framework for predicting interactions between protein-protein interaction targets and modulators
  ☆14Updated 2 years ago
• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆68Updated 2 years ago
• DS3Lab / RosENet
  ☆37Updated 4 years ago
• zchwang / DeepRMSD-Vina_Optimization
  DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.
  ☆43Updated 2 years ago
• oxpig / DEVELOP
  ☆57Updated last year
• hnlab / BindingNet
  ☆26Updated last year
• MolecularAI / DockStreamCommunity
  ☆28Updated 2 years ago
• ChatterjeeAyan / AI-Bind
  Interpretable AI pipeline improving binding predictions for novel protein targets and ligands
  ☆32Updated last year
• JU-HuaY / MFR
  ☆10Updated 2 years ago
• MahaThafar / Affinity2Vec
  Drug-target binding affinity prediction using representation learning, graph mining, and machine learning
  ☆25Updated 3 years ago
• keiserlab / autofragdiff
  Autoregressive fragment-based diffusion for target-aware ligand design
  ☆32Updated last year
• CSUBioGroup / BACPI
  A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.
  ☆33Updated 3 years ago
• SongXia-NYU / DiffDock-NMDN
  ☆17Updated this week
• ziqi92 / Modof
  Molecule Optimization via Fragment-based Generative Models
  ☆43Updated 2 years ago
• 595693085 / WGNN-DTA
  a method for CPI and DTA prediction
  ☆11Updated 3 years ago
• kimeguida / POEM
  Pocket-Oriented Elaboration of Molecules: application to CDK8 inhibition
  ☆14Updated 3 years ago
• micahwang / RELATION
  ☆17Updated 3 years ago
• WeiLab-Biology / DeepProSite
  ☆34Updated 2 years ago
• MolecularAI / Lib-INVENT-dataset
  ☆22Updated 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
• BFeng14 / ActFound
  Official implementation for ActFound (Nature Machine Intelligence): A bioactivity foundation model using pairwise meta-learning
  ☆45Updated last year
• m-mokaya / RIOP
  ☆18Updated 2 years ago
• CMACH508 / AlphaDrug
  AlphaDrug: Protein Target Specific De Novo Molecular Generation
  ☆40Updated 3 years ago
• AspirinCode / GENiPPI
  Interface-aware molecular generative framework for protein-protein interaction modulators
  ☆18Updated last year
• jacquesboitreaud / OptiMol
  Optimization of binding affinities in chemical space for drug discovery
  ☆35Updated 3 years ago
• iipharma / transpharmer-repo
  ☆41Updated 10 months ago
• 5AGE-zhang / TocoDecoy
  ☆11Updated 3 years ago
• fimrie / DeLinker
  ☆37Updated 5 years ago