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Paketti: avogadro (1.99.0-1 ja muut)

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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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Imurointi kaikille saataville arkkitehtuureille
Arkkitehtuuri Versio Paketin koko Koko asennettuna Tiedostot
amd64 1.99.0-1+b1 953.4 kt2,390.0 kt [tiedostoluettelo]
arm64 1.99.0-1+b1 941.1 kt2,394.0 kt [tiedostoluettelo]
armel 1.99.0-1+b1 933.9 kt2,337.0 kt [tiedostoluettelo]
armhf 1.99.0-1+b1 935.1 kt2,245.0 kt [tiedostoluettelo]
i386 1.99.0-1+b1 965.2 kt2,393.0 kt [tiedostoluettelo]
mips64el 1.99.0-1+b1 942.4 kt2,550.0 kt [tiedostoluettelo]
ppc64el 1.99.0-1+b1 952.6 kt2,522.0 kt [tiedostoluettelo]
s390x 1.99.0-1+b1 947.5 kt2,406.0 kt [tiedostoluettelo]