Пакунок: apbs (3.4.1-5.1 and others)
Links for apbs
Debian Resources:
Download Source Package apbs:
Maintainers:
External Resources:
- Homepage [www.poissonboltzmann.org]
Similar packages:
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.
Інші пакунки пов'язані з apbs
|
|
|
|
-
- dep: apbs-data (= 3.4.1-5.1)
- data files for APBS (Adaptive Poisson Boltzmann Solver)
-
- dep: libamd3 (>= 1:7.0.1)
- approximate minimum degree ordering library for sparse matrices
-
- dep: libapbs3t64 (= 3.4.1-5.1+b1) [ia64]
- Adaptive Poisson Boltzmann Solver
- dep: libapbs3t64 (= 3.4.1-5.1+b2) [m68k, sh4]
- dep: libapbs3t64 (= 3.4.1-5.1+b3) [not ia64, m68k, sh4]
-
- dep: libarpack2 (>= 2.1) [ia64]
- Fortran77 subroutines to solve large scale eigenvalue problems
-
- dep: libarpack2t64 (>= 2.1) [not ia64]
- Fortran77 subroutines to solve large scale eigenvalue problems
-
- dep: libblas3
- Реалізації основних підпрограм лінійної алгебри (колективна бібліотека)
- or libblas.so.3
- virtual package provided by libatlas3-base, libblas3, libblis4-openmp, libblis4-pthread, libblis4-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libc6 (>= 2.34) [not alpha, ia64, sh4]
- Бібліотека GNU C: спільні бібліотеки
also a virtual package provided by libc6-udeb
- dep: libc6 (>= 2.37) [sh4]
-
- dep: libc6.1 (>= 2.34) [alpha]
- Бібліотека GNU C: спільні бібліотеки
also a virtual package provided by libc6.1-udeb
- dep: libc6.1 (>= 2.37) [ia64]
-
- dep: libcamd3 (>= 1:7.0.1)
- symmetric approximate minimum degree library for sparse matrices
-
- dep: libccolamd3 (>= 1:7.0.1)
- constrained column approximate library for sparse matrices
-
- dep: libcholmod5 (>= 1:7.3.1)
- sparse Cholesky factorization library for sparse matrices
-
- dep: libcolamd3 (>= 1:7.0.1)
- column approximate minimum degree ordering library for sparse matrices
-
- dep: libfetk1.9t64 (>= 3.4.1)
- FETK libraries for APBS (shared libraries)
-
- dep: libgomp1 (>= 4.2.1)
- Підтримувальна бібліотека GCC OpenMP (GOMP)
-
- dep: libjs-mathjax
- JavaScript display engine for LaTeX and MathML
-
- dep: libmaloc1 (>= 0.2-1)
- Object-oriented Abstraction Layer for C
-
- dep: libmpich12 (>= 4.2.0) [armel, armhf, hppa, i386, m68k, sh4, x32]
- Shared libraries for MPICH
-
- dep: libopenmpi3t64 (>= 4.1.6) [not armel, armhf, hppa, i386, m68k, sh4, x32]
- high performance message passing library -- shared library
-
- dep: libspqr4 (>= 1:7.6.1+dfsg) [alpha, ia64]
- sparse QR factorization library
- dep: libspqr4 (>= 1:7.7.0+dfsg) [not alpha, ia64]
-
- dep: libstdc++6 (>= 4.1.1)
- Стандартна бібліотека C++ GNU, версії 3
-
- dep: libsuitesparseconfig7 (>= 1:7.0.1)
- configuration routines for all SuiteSparse modules
-
- dep: libsuperlu6 (>= 6.0.1+dfsg1)
- Direct solution of large, sparse systems of linear equations
-
- dep: libumfpack6 (>= 1:7.0.1)
- sparse LU factorization library
Завантажити apbs
Архітектура | Версія | Розмір пакунка | Розмір після встановлення | Файли |
---|---|---|---|---|
alpha (unofficial port) | 3.4.1-5.1+b3 | 77.6 kB | 1,253.0 kB | [список файлів] |
amd64 | 3.4.1-5.1+b3 | 76.6 kB | 369.0 kB | [список файлів] |
arm64 | 3.4.1-5.1+b3 | 74.7 kB | 1,253.0 kB | [список файлів] |
armel | 3.4.1-5.1+b3 | 75.9 kB | 315.0 kB | [список файлів] |
armhf | 3.4.1-5.1+b3 | 72.7 kB | 263.0 kB | [список файлів] |
hppa (unofficial port) | 3.4.1-5.1+b3 | 80.1 kB | 305.0 kB | [список файлів] |
i386 | 3.4.1-5.1+b3 | 75.7 kB | 359.0 kB | [список файлів] |
ia64 (unofficial port) | 3.4.1-5.1+b1 | 88.2 kB | 384.0 kB | [список файлів] |
m68k (unofficial port) | 3.4.1-5.1+b2 | 75.5 kB | 315.0 kB | [список файлів] |
mips64el | 3.4.1-5.1+b3 | 76.7 kB | 1,254.0 kB | [список файлів] |
ppc64 (unofficial port) | 3.4.1-5.1+b3 | 82.0 kB | 1,253.0 kB | [список файлів] |
ppc64el | 3.4.1-5.1+b3 | 80.8 kB | 1,253.0 kB | [список файлів] |
riscv64 | 3.4.1-5.1+b3 | 76.8 kB | 309.0 kB | [список файлів] |
s390x | 3.4.1-5.1+b3 | 74.3 kB | 312.0 kB | [список файлів] |
sh4 (unofficial port) | 3.4.1-5.1+b2 | 86.2 kB | 1,235.0 kB | [список файлів] |
sparc64 (unofficial port) | 3.4.1-5.1+b3 | 82.2 kB | 18,538.0 kB | [список файлів] |
x32 (unofficial port) | 3.4.1-5.1+b3 | 76.1 kB | 343.0 kB | [список файлів] |