Paketti: libgromacs9 (2024.1-1 ja muut)

[ Source: gromacs  ]

GROMACS molecular dynamics sim, shared libraries

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 the shared library, libgromacs.

Muut pakettiin libgromacs9 liittyvät paketit

• dep: libblas3

  Basic Linear Algebra Reference implementations, shared library

  tai libblas.so.3

  näennäispaketti, jonka toteuttaa libatlas3-base, libblas3, libblis4-openmp, libblis4-pthread, libblis4-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial

• dep: libc6 (>= 2.34) [riscv64]

  GNU-C-kirjasto: jaetut kirjastot
  myös näennäispaketti, jonka toteuttaa libc6-udeb

  dep: libc6 (>= 2.35) [ei riscv64]

• dep: libfftw3-double3 (>= 3.3.10)

  Library for computing Fast Fourier Transforms - Double precision

• dep: libfftw3-single3 (>= 3.3.10)

  Library for computing Fast Fourier Transforms - Single precision

• dep: libgcc-s1 (>= 3.0) [amd64, arm64, mips64el, s390x]

  GCC:n apukirjasto

  dep: libgcc-s1 (>= 3.4) [sparc64]

  dep: libgcc-s1 (>= 3.4.4) [ppc64, ppc64el]

  dep: libgcc-s1 (>= 4.3) [riscv64]

• dep: libgomp1 (>= 6)

  GCC OpenMP (GOMP) support library

• dep: libhwloc15 (>= 2.10.0)

  Hierarchical view of the machine - shared libs

• dep: liblapack3

  Library of linear algebra routines 3 - shared version

  tai liblapack.so.3

  näennäispaketti, jonka toteuttaa libatlas3-base, liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial

• dep: libmuparser2v5 (>= 2.3.4)

  fast mathematical expressions parser library (runtime)

• dep: libopenmpi3t64 (>= 4.1.6)

  high performance message passing library -- shared library

• dep: libstdc++6 (>= 13.1)

  GNU standardi C++ -kirjasto, versio 3

• dep: zlib1g (>= 1:1.2.0)

  pakkauskirjaston ajonaikaistiedostot

Imuroi libgromacs9

Imurointi kaikille saataville arkkitehtuureille

Arkkitehtuuri	Versio	Paketin koko	Koko asennettuna	Tiedostot
amd64	2024.1-1+b1	30,072.4 kt	88,917.0 kt	[tiedostoluettelo]
arm64	2024.1-1+b1	27,151.2 kt	74,209.0 kt	[tiedostoluettelo]
mips64el	2024.1-1+b1	23,870.2 kt	76,497.0 kt	[tiedostoluettelo]
ppc64 (epävirallinen siirros)	2024.1-1+b1	27,093.4 kt	84,705.0 kt	[tiedostoluettelo]
ppc64el	2024.1-1+b1	28,708.6 kt	82,659.0 kt	[tiedostoluettelo]
riscv64	2024.1-1+b1	27,877.5 kt	63,461.0 kt	[tiedostoluettelo]
s390x	2024.1-1+b1	22,568.3 kt	74,389.0 kt	[tiedostoluettelo]
sparc64 (epävirallinen siirros)	2024.1-1+b1	23,230.9 kt	74,955.0 kt	[tiedostoluettelo]