Пакет: avogadro (1.97.0-1)

[ Източник: avogadro  ]

Molecular Graphics and Modelling System

Avogadro is a molecular graphics and modelling system targeted at molecules and biomolecules. It can visualize properties like molecular orbitals or electrostatic potentials and features an intuitive molecular builder.

Features include:

 * Molecular modeller with automatic force-field based geometry optimization
 * Molecular Mechanics including constraints and conformer searches
 * Visualization of molecular orbitals and general isosurfaces
 * Visualization of vibrations and plotting of vibrational spectra
 * Support for crystallographic unit cells
 * Input generation for the Gaussian, GAMESS and MOLPRO quantum chemistry
   packages
 * Flexible plugin architecture and Python scripting

File formats Avogadro can read include PDB, XYZ, CML, CIF, Molden, as well as Gaussian, GAMESS and MOLPRO output.

Етикети: Field: Chemistry, User Interface: Graphical User Interface, X Window System, Role: role::program, uitoolkit::qt, Purpose: Data Visualization, X Window System: Application

Други пакети, свързани с avogadro

• dep: libavogadro2-1 (>= 1.97.0)

  Molecular Graphics and Modelling System (library)

• dep: libc6 (>= 2.14) [amd64]

  GNU C Library: Shared libraries
  също и виртуален пакет, предлаган от libc6-udeb

  dep: libc6 (>= 2.17) [arm64, ppc64el]

  dep: libc6 (>= 2.4) [не amd64, arm64, ppc64el]

• dep: libgcc-s1 (>= 3.0) [не armel, armhf]

  GCC support library

  dep: libgcc-s1 (>= 3.5) [armel, armhf]

• dep: libqt5core5a (>= 5.15.1)

  Qt 5 core module

• dep: libqt5gui5 (>= 5.7.0)

  Qt 5 GUI module

  или libqt5gui5-gles (>= 5.7.0)

  Qt 5 GUI module — OpenGL ES variant

• dep: libqt5network5 (>= 5.0.2)

  Qt 5 network module

• dep: libqt5widgets5 (>= 5.6.0~beta)

  Qt 5 widgets module

• dep: libstdc++6 (>= 5.2)

  GNU Standard C++ Library v3

• rec: avogadro-utils

  Molecular Graphics and Modelling System (library)

• rec: molequeue

  Desktop integration of high performance computing resources

Изтегляне на avogadro

Изтегляне за всички налични архитектури

Архитектура	Големина на пакета	Големина след инсталиране	Файлове
amd64	1 225,5 кБ	5 030,0 кБ	[списък на файловете]
arm64	1 214,6 кБ	5 030,0 кБ	[списък на файловете]
armel	1 205,4 кБ	5 029,0 кБ	[списък на файловете]
armhf	1 207,5 кБ	4 901,0 кБ	[списък на файловете]
i386	1 235,3 кБ	5 037,0 кБ	[списък на файловете]
mips64el	1 219,0 кБ	5 184,0 кБ	[списък на файловете]
mipsel	1 217,6 кБ	5 113,0 кБ	[списък на файловете]
ppc64el	1 226,2 кБ	5 222,0 кБ	[списък на файловете]
s390x	1 212,7 кБ	5 050,0 кБ	[списък на файловете]