Performance enhancements for GROMACS nonbonded interactions on BlueGene
نویسندگان
چکیده
منابع مشابه
Performance Analysis on Molecular Dynamics Simulation of Protein Using GROMACS
Development of computer technology in chemistry, bring many application of chemistry. Not only the application to visualize the structure of molecule but also to molecular dynamics simulation. One of them is Gromacs. Gromacs is an example of molecular dynamics application developed by Groningen University. This application is a non-commercial and able to work in the operating system Linux. The ...
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ژورنال
عنوان ژورنال: Journal of Computational Chemistry
سال: 2011
ISSN: 0192-8651
DOI: 10.1002/jcc.21766