Alternatives and similar repositories for MPG

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

• lihan97 / KPGT
  codes for KPGT (Knowledge-guided Pre-training of Graph Transformer)
  ☆116Updated 11 months ago
• jaechanglim / GNN_DTI
  ☆67Updated 5 years ago
• biomed-AI / MolRep
  MolRep: A Deep Representation Learning Library for Molecular Property Prediction
  ☆128Updated 11 months ago
• agave233 / SIGN
  Official implementation of 'Structure-aware Interactive Graph Neural Networks for the Prediction of Protein-Ligand Binding Affinity' (KDD…
  ☆38Updated 3 years ago
• uta-smile / RetroXpert
  ☆64Updated 4 years ago
• guaguabujianle / MGraphDTA
  ☆53Updated last year
• wzxxxx / Knowledge-based-BERT
  K-BERT for molecular property prediction.
  ☆30Updated 3 years ago
• admislf / MINN-DTI
  Effective drug-target interaction prediction with mutual interaction neural network
  ☆33Updated 3 years ago
• SY575 / CMPNN
  ☆76Updated last year
• wzxxxx / MGA
  MGA
  ☆44Updated 4 years ago
• agave233 / GeomGCL
  Official implementation for AAAI 2022 paper: "GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction".
  ☆22Updated 3 years ago
• OpenDrugAI / AttentiveFP
  ☆186Updated 2 years ago
• lmqfly / Geometry-Deep-Learning-for-Drug-Discovery
  Geometry Deep Learning for Drug Discovery and Life Science
  ☆71Updated last year
• JK-Liu7 / AttentionMGT-DTA
  ☆39Updated last year
• biomed-AI / MUSE
  ☆26Updated last year
• 595693085 / DGraphDTA
  a novel DTA predition method using graph neural network
  ☆74Updated 2 years ago
• ZangXuan / HiMol
  ☆26Updated 2 years ago
• idrugLab / FP-GNN
  ☆67Updated 2 years ago
• teslacool / UnifiedMolPretrain
  Unified 2D and 3D Pre-Training of Molecular Representations
  ☆30Updated 3 years ago
• guaguabujianle / ML-DTI
  ☆12Updated 4 years ago
• JU-HuaY / MFR
  ☆10Updated 2 years ago
• lishuya17 / MONN
  MONN: a Multi-Objective Neural Network for Predicting Pairwise Non-Covalent Interactions and Binding Affinities between Compounds and Pro…
  ☆104Updated 4 years ago
• chao1224 / GeoSSL
  GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…
  ☆47Updated 2 years ago
• ziqi92 / Modof
  Molecule Optimization via Fragment-based Generative Models
  ☆42Updated 2 years ago
• prokia / drugVQA
  Predicting Drug Protein Interaction using Quasi-Visual Question Answering System
  ☆123Updated last year
• jiaor17 / 3D-EMGP
  [AAAI 2023] The implementation for the paper "Energy-Motivated Equivariant Pretraining for 3D Molecular Graphs"
  ☆33Updated last year
• zaixizhang / FLAG
  Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"
  ☆69Updated last year
• uta-smile / SMILES-BERT
  ☆51Updated 4 years ago
• kamikaze0923 / jtvae
  Junctional Tree Variational Auto-encoder
  ☆25Updated 5 years ago
• otori-bird / retrosynthesis
  ☆70Updated last year