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) [kfreebsd-amd64, kfreebsd-i386]

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

• dep: libc6 (>= 2.2.5) [amd64]

  Sulautettu GNU C -kirjasto: jaetut kirjastot
  also a virtual package provided by libc6-udeb

  dep: libc6 (>= 2.3.6-6~) [i386]

  dep: libc6 (>= 2.4) [armel, mips, mipsel, powerpc, s390]

  dep: libc6 (>= 2.6) [sparc]

• dep: libc6.1 (>= 2.2) [ia64]

  Sulautettu GNU C -kirjasto: jaetut kirjastot
  also a virtual package provided by libc6.1-udeb

• dep: libgcc1 [kfreebsd-amd64, kfreebsd-i386]

  GCC:n apukirjasto

  dep: libgcc1 (>= 1:4.1.1) [not armel, kfreebsd-amd64, kfreebsd-i386]

  dep: libgcc1 (>= 1:4.4.0) [armel]

• 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 [kfreebsd-amd64, kfreebsd-i386]

  GNU Standard C++ -kirjasto, versio 3

  dep: libstdc++6 (>= 4.4.0) [not kfreebsd-amd64, kfreebsd-i386]

• dep: libunwind7 [ia64]

  A library to determine the call-chain of a program - runtime

• 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
amd64	1.0.1-3+b1	3,766.5 kB	6,672.0 kB	[list of files]
armel	1.0.1-3+b1	3,802.8 kB	6,792.0 kB	[list of files]
i386	1.0.1-3+b1	3,786.7 kB	6,792.0 kB	[list of files]
ia64	1.0.1-3+b1	3,863.0 kB	8,672.0 kB	[list of files]
kfreebsd-amd64	1.0.1-3+b1	3,767.8 kB	6,664.0 kB	[list of files]
kfreebsd-i386	1.0.1-3+b1	3,759.4 kB	6,616.0 kB	[list of files]
mips	1.0.1-3+b1	3,798.2 kB	6,988.0 kB	[list of files]
mipsel	1.0.1-3+b1	3,758.9 kB	6,988.0 kB	[list of files]
powerpc	1.0.1-3+b1	3,799.4 kB	6,840.0 kB	[list of files]
s390	1.0.1-3+b1	3,771.1 kB	6,848.0 kB	[list of files]
sparc	1.0.1-3+b1	3,804.6 kB	6,808.0 kB	[list of files]