Paket: gromacs-mpi (2021.4-2)
gromacs-mpi için bağlantılar
Trisquel Kaynakları:
gromacs Kaynak Paketini İndir:
- [gromacs_2021.4-2.dsc]
- [gromacs_2021.4.orig-regressiontests.tar.gz]
- [gromacs_2021.4.orig.tar.gz]
- [gromacs_2021.4-2.debian.tar.xz]
Geliştirici:
Original Maintainers:
- Debichem Team (Posta Arşivi)
- Nicholas Breen
Dış Kaynaklar:
- Ana Sayfa [www.gromacs.org]
Benzer paketler:
Molecular dynamics sim, binaries for MPI parallelization
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 only the core simulation engine with parallel support using the default MPI interface on the chosen architecture. It is suitable for nodes of a processing cluster, or for multiprocessor machines.
gromacs-mpi ile İlgili Diğer Paketler
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- dep: libc6 (>= 2.34)
- GNU C Library: Shared libraries
ayrıca şunun tarafından sağlanan bir sanal paket libc6-udeb
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- dep: libfftw3-double3 (>= 3.3.5)
- Library for computing Fast Fourier Transforms - Double precision
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- dep: libfftw3-single3 (>= 3.3.5)
- Library for computing Fast Fourier Transforms - Single precision
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- dep: libgcc-s1 (>= 3.3.1) [armhf değil]
- GCC support library
- dep: libgcc-s1 (>= 3.5) [armhf]
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- dep: libgomp1 (>= 4.9)
- GCC OpenMP (GOMP) support library
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- dep: libhwloc15 (>= 2.6.0)
- Hierarchical view of the machine - shared libs
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- dep: libopenmpi3 (>= 4.1.0)
- high performance message passing library -- shared library
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- dep: libstdc++6 (>= 11)
- GNU Standard C++ Library v3
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- dep: mpi-default-bin
- Standard MPI runtime programs (metapackage)
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- dep: sse4.2-support [amd64]
- prevent installation on processors without required instructions
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- dep: zlib1g (>= 1:1.2.0)
- compression library - runtime
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- rec: gromacs
- Molecular dynamics simulator, with building and analysis tools
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- sug: gromacs-data
- GROMACS molecular dynamics sim, data and documentation
gromacs-mpi indir
| Mimari | Paket Boyutu | Kurulu Boyut | Dosyalar |
|---|---|---|---|
| amd64 | 7.071,1 kB | 17283 kB | [dosya listesi] |
| arm64 | 6.348,9 kB | 13457 kB | [dosya listesi] |
| armhf | 3.813,4 kB | 9007 kB | [dosya listesi] |
| ppc64el | 5.218,7 kB | 13429 kB | [dosya listesi] |