Пакет: avogadro (1.100.0-2)

Ссылки для avogadro

Отслеживание заплат eLxr

Исходный код avogadro:

Сопровождающие:

Внешние ресурсы:

Сайт [avogadro.cc]

Подобные пакеты:

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.

Другие пакеты, относящиеся к avogadro

зависимости

рекомендации

предложения

enhances

dep: libavogadro2-1t64 (>= 1.100.0)

Molecular Graphics and Modelling System (library)
dep: libc6 (>= 2.34)

GNU C Library: Shared libraries
также виртуальный пакет, предоставляемый libc6-udeb
dep: libgcc-s1 (>= 3.0)

GCC support library
dep: libqt6core6t64 (>= 6.7.2)

Qt 6 core module
dep: libqt6gui6 (>= 6.1.2)

Qt 6 GUI module
dep: libqt6network6 (>= 6.1.2)

Qt 6 network module
dep: libqt6opengl6 (>= 6.1.2)

Qt 6 OpenGL module
dep: libqt6openglwidgets6 (>= 6.1.2)

Qt 6 OpenGL widgets module
dep: libqt6widgets6 (>= 6.1.2)

Qt 6 widgets module
dep: libstdc++6 (>= 13.1)

GNU Standard C++ Library v3

rec: avogadro-utils

Molecular Graphics and Modelling System (library)
rec: molequeue

Desktop integration of high performance computing resources

Загрузка avogadro

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Архитектура	Размер пакета	В установленном виде	Файлы
amd64	968,2 Кб	2 384,0 Кб	[список файлов]
arm64	956,4 Кб	2 416,0 Кб	[список файлов]