Alternatives and similar repositories for ChemPlot

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

• CDDLeiden / QSPRpred
  A tool for creating Quantitative Structure Property/Activity Relationship (QSPR/QSAR) models.
  ☆84Updated 3 months ago
• greglandrum / rdkit_blog
  RDKit related blog posts, notebooks, and data.
  ☆152Updated last week
• volkamerlab / ai_in_chemistry_workshop
  ai_in_chemistry_workshop
  ☆78Updated last year
• reymond-group / drfp
  An NLP-inspired chemical reaction fingerprint based on basic set arithmetic.
  ☆79Updated 8 months ago
• hesther / espsim
  Scoring of shape and ESP similarity with RDKit
  ☆232Updated 5 months ago
• JacksonBurns / mordred-community
  Community-Maintained Version of mordred
  ☆94Updated last week
• EBjerrum / scikit-mol
  scikit-learn classes for molecular vectorization using RDKit
  ☆200Updated 3 months ago
• basf / MolPipeline
  A Python package for processing molecules with RDKit in scikit-learn
  ☆213Updated last week
• EBjerrum / rdeditor
  Simple RDKit molecule editor GUI using PySide
  ☆167Updated last year
• molecularinformatics / Computational-ADME
  ☆100Updated last year
• PatWalters / rd_filters
  A script to run structural alerts using the RDKit and ChEMBL
  ☆155Updated 2 years ago
• isayevlab / Auto3D_pkg
  Auto3D generates low-energy conformers from SMILES/SDF
  ☆187Updated 2 weeks ago
• HFooladi / GNNs-For-Chemists
  Implementations of different GNNs from scratch for chemists
  ☆161Updated last month
• molecularinformatics / roshambo
  ☆92Updated last year
• mqcomplab / iSIM
  Module containing scripts to perform multiple comparison simultaneously and getting the exact same value as the average pairwise comparis…
  ☆59Updated 2 months ago
• PatWalters / useful_rdkit_utils
  Some useful RDKit functions
  ☆215Updated 3 weeks ago
• cole-group / FEgrow
  An Open-Source Molecular Builder and Free Energy Preparation Workflow
  ☆137Updated 2 months ago
• durrantlab / dimorphite_dl
  Adds or removes hydrogen atoms to achieve the appropriate molecular protonation state for a user-specified pH range
  ☆52Updated last month
• mqcomplab / bitbirch
  BitBIRCH clustering algorithm
  ☆116Updated 3 months ago
• molinfo-vienna / CDPKit
  The Chemical Data Processing Toolkit
  ☆109Updated last week
• reymond-group / RAscore
  Retrosynthetic Accessibility (RA) score learned from computer aided synthesis planning
  ☆92Updated 4 years ago
• rinikerlab / lightweight-registration
  lwreg is a lightweight registration system for chemical registration and data storage.
  ☆81Updated this week
• matteoferla / Fragmenstein
  Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse
  ☆203Updated last year
• ghiander / novana
  Cheminformatics tool that extends the decomposition of molecules into Bemis-Murcko frameworks.
  ☆52Updated 10 months ago
• PatWalters / TS
  Thompson Sampling
  ☆79Updated 8 months ago
• DrrDom / rdkit-scripts
  rdkit scripts making life easier
  ☆77Updated last month
• dptech-corp / Uni-pKa
  The official repository of Uni-pKa
  ☆92Updated 10 months ago
• connorcoley / scscore
  ☆115Updated 5 years ago
• chembl / FPSim2
  Simple package for fast molecular similarity searches
  ☆161Updated 2 weeks ago
• czodrowskilab / Machine-learning-meets-pKa
  ☆77Updated 2 years ago