Balík: apbs (3.0.0+dfsg1-3build2)

Odkazy pre apbs

Zdroje Trisquel:

Stiahnuť zdrojový balík apbs:

Správca:

Debichem Team (Konferencia)

Original Maintainers:

Debichem Team (Konferencia)
Michael Banck

Externé zdroje:

Domovská stránka [www.poissonboltzmann.org]

Podobné balíky:

Adaptive Poisson Boltzmann Solver

APBS is a software package for the numerical solution of the Poisson-Boltzmann equation (PBE), one of the most popular continuum models for describing electrostatic interactions between molecular solutes in salty, aqueous media. Continuum electrostatics plays an important role in several areas of biomolecular simulation, including:

  * simulation of diffusional processes to determine ligand-protein and
    protein-protein binding kinetics,
  * implicit solvent molecular dynamics of biomolecules ,
  * solvation and binding energy calculations to determine
    ligand-protein and protein-protein equilibrium binding constants
    and aid in rational drug design,
  * and biomolecular titration studies.

APBS was designed to efficiently evaluate electrostatic properties for such simulations for a wide range of length scales to enable the investigation of molecules with tens to millions of atoms.

This package contains the apbs program and utilities.

Ostatné balíky súvisiace s balíkom apbs

závisí

odporúča

navrhuje

dep: apbs-data (= 3.0.0+dfsg1-3build2)

data files for APBS (Adaptive Poisson Boltzmann Solver)
dep: libapbs3 (= 3.0.0+dfsg1-3build2)

Adaptive Poisson Boltzmann Solver
dep: libc6 (>= 2.34)

GNU C Library: Shared libraries
tiež virtuálny balík poskytovaný balíkom libc6-udeb
dep: libgomp1 (>= 4.2.1)

GCC OpenMP (GOMP) support library
dep: libmaloc1 (>= 0.2-1)

Object-oriented Abstraction Layer for C
dep: libopenmpi3 (>= 4.1.2)

high performance message passing library -- shared library
dep: libstdc++6 (>= 4.1.1)

GNU Standard C++ Library v3

Stiahnuť apbs

Stiahnuť pre všetky dostupné architektúry
Architektúra	Veľkosť balíka	Nainštalovaná veľkosť	Súbory
amd64	81.9 kB	434 kB	[zoznam súborov]
arm64	78.2 kB	362 kB	[zoznam súborov]
armhf	77.3 kB	300 kB	[zoznam súborov]
ppc64el	87.1 kB	1302 kB	[zoznam súborov]

Sections