OpenMM 7.4 / PyOpenMM 4.0
:: DESCRIPTION
OpenMM is a library which provides tools for modern molecular modeling simulation. As a library it can be hooked into any code, allowing that code to do molecular modeling with minimal extra coding.
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PyOpenMM is a python API that wraps the OpenMM library.
::DEVELOPER
:: SCREENSHOTS
N/A
:: REQUIREMENTS
- Windows / Mac OsX/ Linux
- Python
:: DOWNLOAD
:: MORE INFORMATION
Citation
M. S. Friedrichs, P. Eastman, V. Vaidyanathan, M. Houston, S. LeGrand, A. L. Beberg, D. L. Ensign, C. M. Bruns, V. S. Pande.
“Accelerating Molecular Dynamic Simulation on Graphics Processing Units.”
J. Comp. Chem., 30(6):864-872 (2009)