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The Top 16 C Plus Plus Cheminformatics Open Source Projects

Open source projects categorized as C Plus Plus Cheminformatics
Categories > Programming Languages > C Plus Plus
Categories > Science > Cheminformatics
Rdkit ⭐ 2,323
The official sources for the RDKit library
dependent packages 21total releases 43most recent commit 3 months ago
Openbabel ⭐ 927
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
dependent packages 6total releases 2most recent commit 3 months ago
Gnina ⭐ 495
A deep learning framework for molecular docking
most recent commit 4 months ago
Indigo ⭐ 263
Universal cheminformatics toolkit, utilities and database search tools
dependent packages 5total releases 57most recent commit 3 months agopypi epam.indigo} Downloads
Chemfiles ⭐ 150
Library for reading and writing chemistry files
dependent packages 2total releases 15most recent commit 5 months ago
Gpusimilarity ⭐ 85
A Cuda/Thrust implementation of fingerprint similarity searching
most recent commit 3 months ago
Chemkit ⭐ 44
A C++ library for molecular modelling, cheminformatics and molecular visualization.
most recent commit 5 years ago
Indigo ⭐ 42
Indigo: a cheminformatics toolkit. Bingo: RDBMS data cartridge for Oracle, MS SQL Server, and PostgreSQL
most recent commit 2 years ago
Lemon ⭐ 22
A framework for rapidly mining structural information from the Protein Data Bank
total releases 5most recent commit 4 years ago
Molpher Lib ⭐ 12
C++/Python Library for Systematic Chemical Space Exploration
most recent commit 3 years ago
Vespucci ⭐ 12
A free (open source), cross-platform tool for spectroscopic data analysis and imaging
most recent commit 4 years ago
Mofid ⭐ 11
A system for rapid identification and analysis of metal-organic frameworks
most recent commit 2 years ago
Mongochem ⭐ 10
Qt MongoDB desktop cheminformatics application - this project is no longer active
most recent commit 9 years ago
Chemmineob ⭐ 9
OpenBabel wrapper package for R
most recent commit 3 months ago
Chempp ⭐ 7
[paused development] Large scale concurrent chemical search using RDKit cartridge, Oat++ and native Postgres & C++ features.
most recent commit 2 years ago
Chemical_visualizer ⭐ 5
View PDB and MOL file's 3D structures
most recent commit a year ago
The 4 Most Depended On C Plus Plus Cheminformatics Open Source Projects
Rdkit ⭐ 2,323
The official sources for the RDKit library
dependent packages 21total releases 43latest release October 25, 2022most recent commit 3 months ago
Openbabel ⭐ 927
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
dependent packages 6total releases 2latest release November 02, 2021most recent commit 3 months ago
Indigo ⭐ 263
Universal cheminformatics toolkit, utilities and database search tools
dependent packages 5total releases 57latest release December 11, 2023most recent commit 3 months agopypi epam.indigo} Downloads
Chemfiles ⭐ 150
Library for reading and writing chemistry files
dependent packages 2total releases 15latest release August 28, 2022most recent commit 5 months ago
The 5 Latest Releases In C Plus Plus Cheminformatics Open Source Projects
Indigo ⭐ 263
Universal cheminformatics toolkit, utilities and database search tools
dependent packages 5total releases 57latest release December 11, 2023most recent commit 3 months agopypi epam.indigo} Downloads
Rdkit ⭐ 2,323
The official sources for the RDKit library
dependent packages 21total releases 43latest release October 25, 2022most recent commit 3 months ago
Chemfiles ⭐ 150
Library for reading and writing chemistry files
dependent packages 2total releases 15latest release August 28, 2022most recent commit 5 months ago
Openbabel ⭐ 927
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
dependent packages 6total releases 2latest release November 02, 2021most recent commit 3 months ago
Lemon ⭐ 22
A framework for rapidly mining structural information from the Protein Data Bank
total releases 5latest release June 02, 2020most recent commit 4 years ago
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