[ddp] avogadro : Molecular Graphics and Modelling System

[daily-debian-package at enix.org]

Hello,

Today, I'm happy to present you the Debian package avogadro, which is
part of the science section, and maintained by Debichem Team
<debichem-devel at lists.alioth.debian.org>. 

This package contains : 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.


Package homepage     :
 http://packages.debian.org/unstable/science/avogadro

Package bug homepage :
 http://bugs.debian.org/avogadro

Package QA homepage  :
 http://packages.qa.debian.org/avogadro

Have fun with Debian packages !

-- 
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Daily-debian-package at the-doors.enix.org
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