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软件包: gromacs-data (2018.1-1)

GROMACS molecular dynamics sim, data and documentation

GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.

It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers.

This package contains architecture-independent topology and force field data, documentation, man pages, and example files.

其他与 gromacs-data 有关的软件包

  • 依赖
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  • 建议
  • rec: gromacs
    Molecular dynamics simulator, with building and analysis tools
  • sug: tcsh
    TENEX C Shell, an enhanced version of Berkeley csh
    或者 c-shell
    本虚包由这些包填实: csh, tcsh

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