Skip to content
Sections
>> Trisquel >> Пакеты >> etiona >> libs >> libopenbabel4v5
[  etiona  ]
[ Источник: openbabel  ]

Пакет: libopenbabel4v5 (2.3.2+dfsg-3build1)

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.

Другие пакеты, относящиеся к libopenbabel4v5

  • зависимости
  • рекомендации
  • предложения
  • dep: libc6 (>= 2.14) [amd64]
    GNU C Library: Shared libraries
    также виртуальный пакет, предоставляемый libc6-udeb
    dep: libc6 (>= 2.4) [i386]
  • dep: libcairo2 (>= 1.2.4)
    Cairo 2D vector graphics library
  • dep: libgcc1 (>= 1:4.0)
    GCC support library
  • dep: libgomp1 (>= 4.9)
    GCC OpenMP (GOMP) support library
  • dep: libstdc++6 (>= 5.2)
    GNU Standard C++ Library v3
  • dep: libxml2 (>= 2.7.4)
    GNOME XML library
  • dep: zlib1g (>= 1:1.1.4)
    compression library - runtime

Загрузка libopenbabel4v5

Загрузить для всех доступных архитектур
Архитектура Размер пакета В установленном виде Файлы
amd64 2 601,2 Кб11025 Кб [список файлов]
i386 2 699,1 Кб10807 Кб [список файлов]