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[ 源代码: gromacs  ]

软件包:gromacs(2020.6-2)

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Molecular dynamics simulator, with building and analysis tools

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.

标签: 领域: 生物学, 结构生物学, field::chemistry, implemented-in::c, 用户接口: 命令行, interface::graphical, interface::x11, 角色: 程序, 界面工具箱: X 库, X 窗口系统: 应用程序

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硬件架构 软件包大小 安装后大小 文件
amd64 133.9 kB523.0 kB [文件列表]