Alternatives and similar repositories for MFR

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

• admislf / MINN-DTI
  Effective drug-target interaction prediction with mutual interaction neural network
  ☆32Updated 3 years ago
• zjujdj / InteractionGraphNet
  InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…
  ☆45Updated 2 years ago
• Wang-Lin-boop / GeminiMol
  Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…
  ☆55Updated 3 weeks ago
• wzxxxx / MGA
  MGA
  ☆44Updated 4 years ago
• lifanchen-simm / transformerCPI2.0
  Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that…
  ☆70Updated 2 years ago
• ComputArtCMCG / PLANET
  ☆65Updated last year
• OdinZhang / ResGen
  3D_Molecular_Generation
  ☆97Updated 8 months ago
• Chokyotager / NotYetAnotherNightshade
  Graph variational encoders for drug engineering and potentiation
  ☆30Updated 2 years ago
• CSUBioGroup / BACPI
  A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.
  ☆32Updated 2 years ago
• biomed-AI / MUSE
  ☆26Updated last year
• wzxxxx / Knowledge-based-BERT
  K-BERT for molecular property prediction.
  ☆30Updated 3 years ago
• guaguabujianle / MGraphDTA
  ☆53Updated 11 months ago
• anny0316 / GEOM-CVAE
  ☆15Updated 4 years ago
• CAODH / EquiScore
  ☆76Updated last year
• sc8668 / RTMScore
  ☆104Updated 2 years ago
• sun-heqi / MultiPPIMI
  A deep learning framework for predicting interactions between protein-protein interaction targets and modulators
  ☆14Updated last year
• pengxingang / PocketXMol
  Implementation of PocketXMol, the pocket-interacting molecular generative foundation model.
  ☆63Updated last month
• CMACH508 / KGDiff
  Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance
  ☆34Updated last year
• schrojunzhang / KarmaDock
  ☆119Updated last year
• guaguabujianle / GIGN
  ☆44Updated 2 years ago
• zchwang / DeepRMSD-Vina_Optimization
  DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.
  ☆42Updated last year
• guaguabujianle / ML-DTI
  ☆12Updated 4 years ago
• ChengF-Lab / ImageMol
  ☆45Updated last year
• stonewiseAIDrugDesign / Lingo3DMol
  ☆57Updated last year
• j9650 / MedusaGraph
  ☆28Updated 2 years ago
• AndMastro / protein-ligand-GNN
  This repository contains the code for the work on protein-ligand interaction with GNNs and XAI
  ☆35Updated last year
• tiantz17 / PocketAnchor
  Learning Structure-based Pocket Representations for Protein-Ligand Interaction Prediction
  ☆34Updated last year
• CSUBioGroup / PGMG
  The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.
  ☆62Updated last year
• zaixizhang / FLAG
  Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"
  ☆69Updated last year
• LondonLab / PRosettaC
  ☆33Updated 3 years ago