Alternatives and similar repositories for ML-DTI

Users that are interested in ML-DTI 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
• JU-HuaY / MFR
  ☆10Updated 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
• CSUBioGroup / BACPI
  A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.
  ☆32Updated 2 years ago
• wzxxxx / Knowledge-based-BERT
  K-BERT for molecular property prediction.
  ☆31Updated 3 years ago
• ChengF-Lab / ImageMol
  ☆45Updated last year
• agave233 / SIGN
  Official implementation of 'Structure-aware Interactive Graph Neural Networks for the Prediction of Protein-Ligand Binding Affinity' (KDD…
  ☆38Updated 3 years ago
• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆64Updated last year
• guaguabujianle / MGraphDTA
  ☆55Updated last year
• OdinZhang / ResGen
  3D_Molecular_Generation
  ☆100Updated 10 months ago
• biomed-AI / MUSE
  ☆26Updated last year
• yazdanimehdi / AttentionSiteDTI
  This is The repository for Paper "AttentionSiteDTI: Attention Based Model for Predicting Drug-Target Interaction Using Graph Representati…
  ☆45Updated last year
• anny0316 / GEOM-CVAE
  ☆15Updated 4 years ago
• LBBSoft / DeepCDA
  DeepCDA
  ☆15Updated 5 years ago
• ziqi92 / Modof
  Molecule Optimization via Fragment-based Generative Models
  ☆42Updated 2 years ago
• pyli0628 / MPG
  ☆47Updated last year
• Chokyotager / NotYetAnotherNightshade
  Graph variational encoders for drug engineering and potentiation
  ☆30Updated 2 years ago
• AndMastro / protein-ligand-GNN
  This repository contains the code for the work on protein-ligand interaction with GNNs and XAI
  ☆36Updated last year
• biomed-AI / STAMP-DPI
  ☆31Updated 3 years ago
• DrugAI / ACNet
  ☆16Updated 3 years ago
• Shihang-Wang-58 / DeepSA
  A Deep-learning Driven Predictor of Compound Synthesis Accessibility
  ☆34Updated 4 months ago
• Wang-Lin-boop / GeminiMol
  Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…
  ☆57Updated 2 months ago
• micahwang / RELATION
  ☆17Updated 2 years ago
• j9650 / MedusaGraph
  ☆28Updated 3 years ago
• guaguabujianle / GIGN
  ☆47Updated 2 years ago
• mindrank-ai / PharmaBench
  ☆46Updated last year
• hskang0906 / DTI-Prediction
  Drug-Target Interactive Prediction Model using ChemBERTa and ProtBert
  ☆15Updated 11 months ago
• jaechanglim / GNN_DTI
  ☆67Updated 5 years ago
• wzxxxx / Prompt-MolOpt
  a multi-property optimization method.
  ☆32Updated 9 months ago