Paketti: avogadro (1.97.0-1)

[ Source: 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.

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

Muut pakettiin avogadro liittyvät paketit

• dep: libavogadro2-1 (>= 1.97.0)

  Molecular Graphics and Modelling System (library)

• dep: libc6 (>= 2.14) [amd64]

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

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

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

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

  GCC:n apukirjasto

  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

  tai 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 standardi C++ -kirjasto, versio 3

• rec: avogadro-utils

  Molecular Graphics and Modelling System (library)

• rec: molequeue

  Desktop integration of high performance computing resources

Imuroi avogadro

Imurointi kaikille saataville arkkitehtuureille

Arkkitehtuuri	Paketin koko	Koko asennettuna	Tiedostot
amd64	1,225.5 kt	5,030.0 kt	[tiedostoluettelo]
arm64	1,214.6 kt	5,030.0 kt	[tiedostoluettelo]
armel	1,205.4 kt	5,029.0 kt	[tiedostoluettelo]
armhf	1,207.5 kt	4,901.0 kt	[tiedostoluettelo]
i386	1,235.3 kt	5,037.0 kt	[tiedostoluettelo]
mips64el	1,219.0 kt	5,184.0 kt	[tiedostoluettelo]
mipsel	1,217.6 kt	5,113.0 kt	[tiedostoluettelo]
ppc64el	1,226.2 kt	5,222.0 kt	[tiedostoluettelo]
s390x	1,212.7 kt	5,050.0 kt	[tiedostoluettelo]