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Paket: libopenbabel7 (3.1.1+dfsg-6ubuntu5)

Chemical toolbox library

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 shared library.

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  • dep: libc6 (>= 2.34)
    GNU C Library: Shared libraries
    auch ein virtuelles Paket, bereitgestellt durch libc6-udeb
  • dep: libcairo2 (>= 1.2.4)
    Cairo 2D vector graphics library
  • dep: libgcc-s1 (>= 3.3.1) [arm64, ppc64el]
    GCC support library
    dep: libgcc-s1 (>= 3.4) [amd64]
    dep: libgcc-s1 (>= 3.5) [armhf]
  • dep: libgomp1 (>= 4.9)
    GCC OpenMP (GOMP) support library
  • dep: libinchi1 (>= 1.03+dfsg)
    International Chemical Identifier (InChI) algorithm (library)
  • dep: libmaeparser1 (>= 1.2.4)
    parser for Schrödinger Maestro files
  • dep: libstdc++6 (>= 11)
    GNU Standard C++ Library v3
  • dep: libxml2 (>= 2.7.4)
    GNOME XML library
  • dep: zlib1g (>= 1:1.1.4)
    compression library - runtime

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amd64 3.155,5 kB14535 kB [Liste der Dateien]
arm64 3.031,2 kB12759 kB [Liste der Dateien]
armhf 3.048,6 kB11204 kB [Liste der Dateien]
ppc64el 3.539,6 kB27183 kB [Liste der Dateien]