Pakket: openbabel-gui (2.4.1+dfsg-3)

[ Bron: openbabel  ]

Chemical toolbox utilities (graphical user interface)

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It allows one to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas. Features include:

 * Hydrogen addition and deletion
 * Support for Molecular Mechanics
 * Support for SMARTS molecular matching syntax
 * Automatic feature perception (rings, bonds, hybridization, aromaticity)
 * Flexible atom typer and perception of multiple bonds from atomic coordinates
 * Gasteiger-Marsili partial charge calculation

File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.

This package contains the openbabel GUI based on wxWidgets.

Tags: User Interface: Graphical User Interface, X Window Systeem, Role: role::program, uitoolkit::wxwidgets, X Window Systeem: Application

Andere aan openbabel-gui gerelateerde pakketten

• dep: libc6 (>= 2.14) [amd64]

  GNU C Bibliotheek: Gedeelde bibliotheken
  Ook een virtueel pakket geboden door: libc6-udeb

  dep: libc6 (>= 2.17) [arm64]

  dep: libc6 (>= 2.4) [armhf, i386]

• dep: libgcc1 (>= 1:3.0) [niet armhf]

  GCC support bibliotheek

  dep: libgcc1 (>= 1:3.5) [armhf]

• dep: libgomp1 (>= 4.2.1)

  GCC OpenMP (GOMP) support library

• dep: libopenbabel5

  Chemical toolbox library

• dep: libstdc++6 (>= 5.2)

  GNU Standard C++ Library v3

• dep: libwxbase3.0-0v5 (>= 3.0.4+dfsg)

  wxBase library (runtime) - non-GUI support classes of wxWidgets toolkit

• dep: libwxgtk3.0-0v5 (>= 3.0.4+dfsg)

  wxWidgets Cross-platform C++ GUI toolkit (GTK+ runtime)

• dep: zlib1g (>= 1:1.1.4)

  compressiebibliotheek - programma's

openbabel-gui downloaden

Pakket downloaden voor alle beschikbare platforms

Platform	Pakketgrootte	Geïnstalleerde grootte	Bestanden
amd64	97,1 kB	399,0 kB	[overzicht]
arm64	88,7 kB	366,0 kB	[overzicht]
armhf	84,4 kB	240,0 kB	[overzicht]
i386	99,0 kB	320,0 kB	[overzicht]