软件包:libgromacs-dev(2025.0~beta-1) [debports]
试制(Experimental)软件包
警告:这个软件包来自于 experimental 发行版。这表示它很有可能表现出不稳定或者出现 bug ,甚至是导致资料损失。请务必在使用之前查阅 changelog 以及其他潜在的文档。
GROMACS molecular dynamics sim, 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.
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 header files and static libraries for development purposes, plus sample Makefiles. Development components for MPI-enabled GROMACS builds also require their respective packages.
其他与 libgromacs-dev 有关的软件包
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- dep: libfftw3-dev
- Library for computing Fast Fourier Transforms - development
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- dep: libgromacs10 (= 2025.0~beta-1)
- GROMACS molecular dynamics sim, shared libraries
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- rec: gromacs-data
- GROMACS molecular dynamics sim, data and documentation
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- sug: mpi-default-bin
- Standard MPI runtime programs (metapackage)
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- sug: mpi-default-dev
- Standard MPI development files (metapackage)
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- sug: zlib1g-dev
- 压缩库 - 开发文件