Alternatives and similar repositories for Reaction-Condition-Selector

Users that are interested in Reaction-Condition-Selector are comparing it to the libraries listed below

• yydiao1025 / MacFrag
  ☆27Updated 2 years ago
• batistagroup / DirectMultiStep
  DirectMultiStep: Direct Route Generation for Multistep Retrosynthesis
  ☆24Updated 3 weeks ago
• pfizer-opensource / transform-molecules
  ☆17Updated 2 years ago
• molML / RUSH
  ☆19Updated 8 months ago
• hnlab / BindingNet
  ☆25Updated last year
• dmw51 / reactiondataextractor2
  This repo contains ReactionDataExtractor v.2 - software toolkit for extraction of information from chemical reaction schemes
  ☆29Updated 2 years ago
• qiangbo1222 / Uni-RXN-official
  ☆28Updated last year
• molML / traversing_chem_space
  ☆27Updated last year
• Shihang-Wang-58 / DeepSA
  A Deep-learning Driven Predictor of Compound Synthesis Accessibility
  ☆35Updated 4 months ago
• Laboratoire-de-Chemoinformatique / Reaction_Data_Cleaning
  Chemical reaction data cleaning
  ☆30Updated 3 years ago
• zw-SIMM / SFTLLMs_for_ChemText_Mining
  ☆28Updated last year
• w-jaworski / AtomMap
  ☆13Updated 2 years ago
• antwiser / OptADMET
  ☆10Updated 2 years ago
• iipharma / transpharmer-repo
  ☆40Updated 7 months ago
• ashipiling / GPT_3DSMILES
  ☆31Updated 2 months ago
• karanicolaslab / combichem
  Virtual screening approach for fragments selection and merging to lead-like compounds
  ☆13Updated 4 years ago
• MolecularAI / aizynthtrain
  Tools to train synthesis prediction models
  ☆28Updated last year
• coleygroup / rdcanon
  SMARTS sanitization
  ☆32Updated 4 months ago
• cadd-synthetic / GASA
  Synthetic Accessible Prediction of Organic Compounds based on Graph Attention Mechanism
  ☆22Updated 2 years ago
• THGLab / SynLlama
  Code Space of SynLlama
  ☆35Updated 4 months ago
• Academich / reagents
  Reagent prediction with Molecular Transformer. Improvement of data for reaction product prediction in a self-supervised fashion.
  ☆28Updated last year
• licheng-xu-echo / RXNGraphormer
  Official implementation of "A unified pre-trained deep learning framework for cross-task reaction performance prediction and synthesis pl…
  ☆23Updated 2 weeks ago
• MolecularAI / DockStreamCommunity
  ☆26Updated 2 years ago
• durrantlab / deepfrag
  DeepFrag is a deep convolutional neural network that guides ligand optimization by extending a ligand with a molecular fragment, such tha…
  ☆28Updated 4 months ago
• oxpig / MolSnapper
  ☆51Updated 5 months ago
• MolecularAI / Lib-INVENT-dataset
  ☆21Updated 2 years ago
• WangZiXubiubiu / SketchMol-v1
  Official implementation of SketchMol.
  ☆30Updated 8 months ago
• zhangruochi / MolFeSCue
  ☆12Updated last year
• litfsindt / LIT-SpaceDock
  ☆17Updated last year
• NTU-MedAI / MolFrag
  Obtain and organize all feasible fragmentation of molecular methods
  ☆33Updated 2 years ago