Package: avogadro (1.99.0-1)

[ 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.

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

Other Packages Related to avogadro

• dep: libavogadro2-1 (>= 1.99.0)

  Molecular Graphics and Modelling System (library)

• dep: libc6 (>= 2.34)

  GNU C Library: Shared libraries
  also a virtual package provided by libc6-udeb

• dep: libgcc-s1 (>= 3.0) [not 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

  or 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

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Download for all available architectures

Architecture	Package Size	Installed Size	Files
amd64	953.1 kB	2,389.0 kB	[list of files]
arm64	941.3 kB	2,393.0 kB	[list of files]
armel	931.7 kB	2,328.0 kB	[list of files]
armhf	934.1 kB	2,240.0 kB	[list of files]
i386	965.2 kB	2,392.0 kB	[list of files]
mips64el	941.8 kB	2,549.0 kB	[list of files]
ppc64el	952.2 kB	2,521.0 kB	[list of files]
s390x	947.3 kB	2,405.0 kB	[list of files]