Package: avogadro (1.0.1-3 and others)

[ Source: avogadro  ]

Molecular Graphics and Modelling System

Avogadro is a molecular graphics and modelling system targetted 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, Role: Program, Interface Toolkit: Qt, Purpose: Data Visualization

Other Packages Related to avogadro

• dep: libavogadro1 (= 1.0.1-3+b1)

  Molecular Graphics and Modelling System (library)

• dep: libc0.1 (>= 2.3)

  Sulautettu GNU C -kirjasto: jaetut kirjastot
  also a virtual package provided by libc0.1-udeb

• dep: libgcc1

  GCC:n apukirjasto

• dep: libgl1-mesa-glx

  A free implementation of the OpenGL API -- GLX runtime

  or libgl1

  virtual package provided by libgl1-mesa-glx, libgl1-mesa-swx11

• dep: libopenbabel3

  Chemical toolbox library

• dep: libqt4-opengl (>= 4:4.5.3)

  Qt 4 OpenGL module

• dep: libqtcore4 (>= 4:4.6.1)

  Qt 4 core module

• dep: libqtgui4 (>= 4:4.5.3)

  Qt 4 GUI module

• dep: libstdc++6

  GNU Standard C++ -kirjasto, versio 3

• dep: libx11-6

  X11 client-side library

• rec: avogadro-data (>= 1.0.0-2)

  Molecular Graphics and Modelling System (Data Files)

Download avogadro

Download for all available architectures

Architecture	Version	Package Size	Installed Size	Files
kfreebsd-i386	1.0.1-3+b1	3,759.4 kB	6,616.0 kB	[list of files]