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[ 源代码: gromacs  ]

软件包:libnblib-gmx-dev(2024.4-1 以及其他的)

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GROMACS molecular dynamics sim, NB-LIB development kit

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.

The goal of NB-LIB is to enable researchers to programmatically define molecular simulations. Traditionally these have been performed using a collection of executables and a manual workflow followed by a “black-box” simulation engine. NB-LIB allows users to script a variety of novel simulation and analysis workflows at a more granular level.

This package contains header files for NB-LIB. For the legacy GROMACS API, see libgromacs-dev.

标签: 软件开发: 函数库, 角色: 开发用函数库

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下载 libnblib-gmx-dev

下载可用于所有硬件架构的
硬件架构 版本 软件包大小 安装后大小 文件
amd64 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
arm64 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
ia64 (非官方移植版) 2023.1-2 31.8 kB175.0 kB [文件列表]
mips64el 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
ppc64 (非官方移植版) 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
ppc64el 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
riscv64 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
s390x 2024.4-1+b1 32.8 kB177.0 kB [文件列表]
sparc64 (非官方移植版) 2024.4-1+b1 32.8 kB177.0 kB [文件列表]