套件：openbabel-gui（3.1.1+dfsg-6）

[ 原始碼： 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.

標籤: 使用者介面: Graphical User Interface, X 視窗系統, 角色: role::program, uitoolkit::wxwidgets, X 視窗系統: 應用程式

其他與 openbabel-gui 有關的套件

• dep: libc6 (>= 2.14) [amd64]

  GNU C 函式庫：共用函式庫
  同時作為一個虛擬套件由這些套件填實： libc6-udeb

  dep: libc6 (>= 2.17) [arm64, ppc64el]

  dep: libc6 (>= 2.4) [除 amd64, arm64, ppc64el]

• dep: libgcc-s1 (>= 3.0) [除 armel, armhf]

  GCC 支援函式庫

  dep: libgcc-s1 (>= 3.5) [armel, armhf]

• dep: libopenbabel7 (>= 3.1.1+dfsg)

  Chemical toolbox library

• dep: libstdc++6 (>= 5.2)

  GNU Standard C++ Library v3

• dep: libwxbase3.0-0v5 (>= 3.0.5.1+dfsg)

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

• dep: libwxgtk3.0-gtk3-0v5 (>= 3.0.5.1+dfsg)

  wxWidgets Cross-platform C++ GUI toolkit (GTK 3 runtime)

下載 openbabel-gui

下載可用於所有硬體架構的

硬體架構	套件大小	安裝後大小	檔案
amd64	94。7 kB	389。0 kB	[檔案列表]
arm64	86。0 kB	360。0 kB	[檔案列表]
armel	81。1 kB	266。0 kB	[檔案列表]
armhf	82。2 kB	234。0 kB	[檔案列表]
i386	97。2 kB	314。0 kB	[檔案列表]
mips64el	85。3 kB	375。0 kB	[檔案列表]
mipsel	85。9 kB	328。0 kB	[檔案列表]
ppc64el	92。1 kB	429。0 kB	[檔案列表]
s390x	85。7 kB	357。0 kB	[檔案列表]