[ Quellcode: openbabel ]
Paket: python3-openbabel (3.1.1+dfsg-9ubuntu5)
Links für python3-openbabel
Trisquel-Ressourcen:
Quellcode-Paket openbabel herunterladen:
- [openbabel_3.1.1+dfsg-9ubuntu5.dsc]
- [openbabel_3.1.1+dfsg.orig.tar.xz]
- [openbabel_3.1.1+dfsg-9ubuntu5.debian.tar.xz]
Betreuer:
Original Maintainers:
- Debichem Team (E-Mail-Archiv)
- Michael Banck
- Daniel Leidert
- Andrius Merkys
Externe Ressourcen:
- Homepage [openbabel.sourceforge.net]
Ähnliche Pakete:
Chemical toolbox library (Python bindings)
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 Python binding.
Andere Pakete mit Bezug zu python3-openbabel
|
|
|
-
- dep: libc6 (>= 2.32)
- GNU C Library: Shared libraries
auch ein virtuelles Paket, bereitgestellt durch libc6-udeb
-
- dep: libgcc-s1 (>= 3.3.1) [arm64, ppc64el]
- GCC support library
- dep: libgcc-s1 (>= 3.4) [amd64, riscv64]
- dep: libgcc-s1 (>= 3.5) [armhf]
-
- dep: libopenbabel7 (>= 3.1.1+dfsg)
- Chemical toolbox library
-
- dep: libpython3.12t64 (>= 3.12.1)
- Shared Python runtime library (version 3.12)
-
- dep: libstdc++6 (>= 13.1)
- GNU Standard C++ Library v3
-
- dep: python3
- interactive high-level object-oriented language (default python3 version)
- dep: python3 (<< 3.13)
- dep: python3 (>= 3.12~)
python3-openbabel herunterladen
| Architektur | Paketgröße | Größe (installiert) | Dateien |
|---|---|---|---|
| amd64 | 585,4 kB | 3316 kB | [Liste der Dateien] |
| arm64 | 572,2 kB | 3408 kB | [Liste der Dateien] |
| armhf | 582,4 kB | 2720 kB | [Liste der Dateien] |
| ppc64el | 641,7 kB | 4304 kB | [Liste der Dateien] |
| riscv64 | 640,8 kB | 3320 kB | [Liste der Dateien] |