Alternatives and similar repositories for r-BRICS

Users that are interested in r-BRICS are comparing it to the libraries listed below

• MolecularAI / DockStreamCommunity
  ☆26Updated 2 years ago
• DrugAI / ACNet
  ☆16Updated 3 years ago
• f-rianjongdee / bbSelect
  ☆13Updated last year
• yydiao1025 / MacFrag
  ☆27Updated 2 years ago
• hnlab / BindingNet
  ☆25Updated last year
• zhangruochi / MolFeSCue
  ☆12Updated last year
• mathcom / COMA
  COMA: Efficient Structure-constrained Molecular Generation using Contractive and Margin losses
  ☆18Updated last year
• Brian-hongyan / DeepCoSI
  DeepCoSI: a Structure-based Deep Graph Learning Network Method for Covalent Binding Site Identification.
  ☆14Updated last year
• chunkyun / ACGCN
  ACGCN: Graph Convolutional Networks for Activity Cliff Prediction Between Matched Molecular Pairs (Park et al., 2022)
  ☆19Updated 2 years ago
• mldlproject / 2021-iCYP-MFE
  Source code and data of the paper entitled "iCYP-MFE: Identifying Human Cytochrome P450 Inhibitors using Multi-task Learning and Molecula…
  ☆17Updated 2 years ago
• molinfo-vienna / apo2ph4
  A versatile workflow for the generation of receptor-based pharmacophore models for virtual screening
  ☆30Updated 4 months ago
• pnnl / solubility-prediction-paper
  ☆15Updated 3 years ago
• WIMNZhao / TS_Enhanced
  Enhanced Thompson Sampling
  ☆10Updated 5 months ago
• adalke / mmpdb
  A package to identify matched molecular pairs and use them to predict property changes.
  ☆24Updated last year
• molML / RUSH
  ☆18Updated 7 months ago
• micahwang / RELATION
  ☆17Updated 2 years ago
• jkwang93 / ChemistGA
  ☆23Updated 3 years ago
• batistagroup / DirectMultiStep
  DirectMultiStep: Direct Route Generation for Multistep Retrosynthesis
  ☆24Updated last week
• sekijima-lab / mermaid
  ☆12Updated 4 years ago
• Abdulk084 / CardioTox
  ☆22Updated 9 months ago
• gaoqiweng / PROTAC-Model
  Integrative modeling of PROTAC-mediated ternary complex
  ☆28Updated 3 years ago
• 5AGE-zhang / TocoDecoy
  ☆12Updated 3 years ago
• litfsindt / LIT-SpaceDock
  ☆17Updated last year
• THGLab / SynLlama
  Code Space of SynLlama
  ☆29Updated 4 months ago
• OpenBioSim / biosimspace_tutorials
  A tutorials suite for BioSimSpace.
  ☆27Updated 5 months ago
• MorganCThomas / MolScore_examples
  Examples of MolScore implementations
  ☆11Updated last year
• MolecularAI / Lib-INVENT-dataset
  ☆21Updated 2 years ago
• sekijima-lab / DiffInt
  ☆17Updated 4 months ago
• molML / traversing_chem_space
  ☆27Updated last year
• biomed-AI / DRlinker
  ☆26Updated 2 years ago