OpenChemistry / openchemistryLinks
Supermodule containing submodules and external project to build all components
☆86Updated 2 weeks ago
Alternatives and similar repositories for openchemistry
Users that are interested in openchemistry are comparing it to the libraries listed below
Sorting:
- The Biochemical Algorithms Library☆73Updated 3 years ago
- Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, …☆210Updated this week
- Modern and fast molecular analysis and modeling library for C++ and Python☆36Updated last month
- The pure C++ implementation of the MMTF API, decoder and encoder.☆21Updated last year
- The Massively Parallel Quantum Chemistry program, MPQC, computes properties of atoms and molecules from first principles using the time i…☆70Updated last year
- Molecular Dynamics in the Open☆78Updated last month
- XDrawChem is a two-dimensional molecule drawing program.☆39Updated 4 years ago
- Desktop integration of high performance computing resources☆26Updated 7 months ago
- Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, …☆75Updated 3 years ago
- Library for reading and writing chemistry files☆182Updated 2 weeks ago
- Biomolecular simulation trajectory/data analysis.☆150Updated 2 weeks ago
- A C++ library for molecular modelling, cheminformatics and molecular visualization.☆55Updated 2 years ago
- Sire Molecular Simulations Framework☆95Updated last year
- A framework for rapidly mining structural information from the Protein Data Bank☆53Updated 5 years ago
- APBS - software for biomolecular electrostatics and solvation☆128Updated 4 years ago
- A lightweight C++11 Monte Carlo molecular simulation engine☆9Updated 7 years ago
- Avogadro 1 is not under active development, the repository was archived in September 2021. Development of Avogadro 2 is being done at htt…☆342Updated 3 years ago
- GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in…☆29Updated 3 years ago
- Tinker9: Next Generation of Tinker with GPU Support☆51Updated last year
- Systematic force field optimization.☆151Updated 6 months ago
- Computational Chemistry Input Generator☆46Updated 6 months ago
- A Framework for Metropolis Monte Carlo Simulation of Molecular Systems☆72Updated this week
- LOOS: a lightweight object-oriented structure analysis library☆125Updated last month
- MD trajectory server☆34Updated last year
- The MolScript program produces publication-quality images of macromolecular 3D structures.☆39Updated 2 years ago
- The Molecular Modelling Toolkit☆52Updated last month
- Tinker: Software Tools for Molecular Design☆141Updated 2 weeks ago
- JupyterLab extension for py3Dmol☆20Updated 3 years ago
- Catalog of Open Source Molecular Modeling Projects☆101Updated 4 months ago
- XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives☆60Updated 2 years ago