Alternatives and similar repositories for CIRpy:

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

• mcs07 / MolVS
  Molecule Validation and Standardization
  ☆170Updated 5 years ago
• digital-chemistry-laboratory / morfeus
  A Python package for calculating molecular features
  ☆171Updated 3 months ago
• greglandrum / rdkit_blog
  RDKit related blog posts, notebooks, and data.
  ☆135Updated this week
• PatWalters / chem_tutorial
  ☆91Updated 3 years ago
• volkamerlab / opencadd
  A Python library for structural cheminformatics
  ☆96Updated last month
• cinfony / cinfony
  Simplified and standard interface to a number of cheminformatics toolkits
  ☆87Updated last year
• apahl / rdkit_ipynb_tools
  RDKit Tools for the IPython Notebook
  ☆46Updated 6 years ago
• mcs07 / ChemSpiPy
  Python wrapper for the ChemSpider API
  ☆115Updated 6 years ago
• whitead / molbloom
  Molecular bloom filter tool
  ☆116Updated 2 weeks ago
• EBjerrum / rdeditor
  Simple RDKit molecule editor GUI using PySide
  ☆151Updated 3 months ago
• Mishima-syk / psikit
  psi4+RDKit
  ☆100Updated 2 years ago
• chembience / chembience
  A Docker-based, cloudable platform for the development of chemoinformatics-centric web applications and microservices.
  ☆44Updated last month
• gorgitko / molminer
  Python library and command-line tool for extracting compounds from scientific literature. Written in Python.
  ☆46Updated 4 years ago
• rdkit / UGM_2016
  Materials from the 2016 RDKit UGM
  ☆40Updated 8 years ago
• hesther / espsim
  Scoring of shape and ESP similarity with RDKit
  ☆214Updated last month
• pnnl / isicle
  In silico chemical library engine for high-accuracy chemical property prediction
  ☆60Updated last month
• open-reaction-database / ord-schema
  Schema for the Open Reaction Database
  ☆100Updated this week
• rinikerlab / lightweight-registration
  ☆71Updated last week
• wjm41 / molplotly
  add-on to plotly which show molecule images on mouseover!
  ☆252Updated last year
• rdkit / UGM_2020
  Materials from the (virtual) 2020 RDKit UGM
  ☆52Updated 4 years ago
• cbouy / mols2grid
  Interactive molecule viewer for 2D structures
  ☆218Updated last year
• MolecularAI / reaction_utils
  Utilities for working with datasets of chemical reactions, reaction templates and template extraction.
  ☆71Updated 3 months ago
• MolecularAI / QSARtuna
  QSARtuna: QSAR model building with the optuna framework
  ☆117Updated 5 months ago
• rdkit / django-rdkit
  ☆55Updated 11 months ago
• kmansouri / OPERA
  Free and open-source application (command line and GUI) providing QSAR models predictions as well as applicability domain and accuracy as…
  ☆97Updated 6 months ago
• joofio / py4chemoinformatics
  Python for chemoinformatics
  ☆110Updated 4 years ago
• reymond-group / map4
  The MinHashed Atom Pair fingerprint of radius 2
  ☆114Updated last year
• ppqm / ppqm
  Enable cheminformatics and quantum chemistry
  ☆72Updated last year
• chembl / FPSim2
  Simple package for fast molecular similarity searches
  ☆126Updated 2 months ago
• mcsorkun / ChemPlot
  A python package for chemical space visualization.
  ☆140Updated 4 months ago