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Paketti: avogadro (1.97.0-1)

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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

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Arkkitehtuuri Paketin koko Koko asennettuna Tiedostot
amd64 1,225.5 kt5,030.0 kt [tiedostoluettelo]
arm64 1,214.6 kt5,030.0 kt [tiedostoluettelo]
armel 1,205.4 kt5,029.0 kt [tiedostoluettelo]
armhf 1,207.5 kt4,901.0 kt [tiedostoluettelo]
i386 1,235.3 kt5,037.0 kt [tiedostoluettelo]
mips64el 1,219.0 kt5,184.0 kt [tiedostoluettelo]
mipsel 1,217.6 kt5,113.0 kt [tiedostoluettelo]
ppc64el 1,226.2 kt5,222.0 kt [tiedostoluettelo]
s390x 1,212.7 kt5,050.0 kt [tiedostoluettelo]