gaoqiweng / PROTAC-Model

Related projects ⓘ

Alternatives and complementary repositories for PROTAC-Model

• deep-scaffold / deep_scaffold
  ☆25Updated 4 years ago
• MolecularAI / Lib-INVENT-dataset
  ☆18Updated last year
• yydiao1025 / MacFrag
  ☆18Updated last year
• karanicolaslab / PROTAC_ternary
  ☆16Updated 2 years ago
• MolecularAI / DockStreamCommunity
  ☆26Updated last year
• fimrie / DeepCoy
  ☆23Updated 9 months ago
• mindrank-ai / PharmaBench
  ☆26Updated 7 months ago
• giaguaro / PROTACable
  PROTACable is an end-to-end in-silico design toolkit for novel PROTACs
  ☆27Updated 5 months ago
• grisoniFr / scaffold_hopping_whales
  Code to perform scaffold hopping and virtual screening using WHALES descriptors.
  ☆31Updated 3 years ago
• micahwang / RELATION
  ☆15Updated 2 years ago
• meddwl / psearch
  3D ligand-based pharmacophore modeling
  ☆46Updated last year
• sekijima-lab / mermaid
  ☆13Updated 3 years ago
• tiantz17 / CARA
  Benchmarking compound activity prediction for real-world drug discovery applications
  ☆10Updated 6 months ago
• zchwang / OnionNet-2
  OnionNet-2 is constructed based on convolutional neural network (CNN) to predict the protein-ligand binding affinity.
  ☆16Updated 8 months ago
• Brian-hongyan / DeepCoSI
  DeepCoSI: a Structure-based Deep Graph Learning Network Method for Covalent Binding Site Identification.
  ☆11Updated last year
• sun-heqi / MultiPPIMI
  A deep learning framework for predicting interactions between protein-protein interaction targets and modulators
  ☆11Updated 11 months ago
• zchwang / DeepRMSD-Vina_Optimization
  DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.
  ☆38Updated 10 months ago
• LondonLab / PRosettaC
  ☆28Updated 2 years ago
• molinfo-vienna / apo2ph4
  A versatile workflow for the generation of receptor-based pharmacophore models for virtual screening
  ☆23Updated last year
• jacquesboitreaud / OptiMol
  Optimization of binding affinities in chemical space for drug discovery
  ☆36Updated last year
• GilbertoPPereira / PROTACability
  ☆11Updated last year
• jRicciL / ML-ensemble-docking
  Improving Structure-Based Virtual Screening with Ensemble Docking and Machine Learning
  ☆22Updated 2 years ago
• 5AGE-zhang / TocoDecoy
  ☆12Updated 2 years ago
• issararab / CToxPred
  Comprehensive cardiotoxicity prediction tool of small molecules on three targets: hERG, Nav1.5, Cav1.2
  ☆18Updated last month
• oxpig / MolSnapper
  ☆22Updated last week
• Vfold-RNA / RLDOCK
  ☆30Updated 7 months ago
• jkwang93 / ChemistGA
  ☆24Updated 2 years ago
• JenniferKim09 / FFLOM
  ☆13Updated last year
• ohuelab / QEPPI
  Quantitative Estimate Index for Early-Stage Screening of Compounds Targeting Protein-Protein Interactions
  ☆18Updated 11 months ago
• tiantz17 / MolSHAP
  Source code for paper "MolSHAP: Interpreting Structure-Activity Relationships for Compound Optimization"
  ☆21Updated last year