Paketti: ghemical (2.98-2) [universe]
Links for ghemical
Ubuntu-palvelut:
Imuroi lähdekoodipaketti ghemical:
Ylläpitäjä:
Please consider filing a bug or asking a question via Launchpad before contacting the maintainer directly.
Original Maintainers (usually from Debian):
- Debichem Team (Mail Archive)
- Michael Banck
- Daniel Leidert (dale)
It should generally not be necessary for users to contact the original maintainer.
External Resources:
- Kotisivu [bioinformatics.org]
Samankaltaisia paketteja:
A GNOME molecular modelling environment
Ghemical is a computational chemistry software package written in C++. It has a graphical user interface and it supports both quantum- mechanics (semi-empirical) models and molecular mechanics models. Geometry optimization, molecular dynamics and a large set of visualization tools using OpenGL are currently available.
Ghemical relies on external code to provide the quantum-mechanical calculations. Semi-empirical methods MNDO, MINDO/3, AM1 and PM3 come from the MOPAC7 package (Public Domain), and are included in the package. The MPQC package is used to provide ab initio methods: the methods based on Hartree-Fock theory are currently supported with basis sets ranging from STO-3G to 6-31G**.
Muut pakettiin ghemical liittyvät paketit
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- dep: libatk1.0-0 (>= 1.20.0)
- The ATK accessibility toolkit
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- dep: libblas3gf
- Basic Linear Algebra Subroutines 3, shared library
- tai libblas.so.3gf
- näennäispaketti, jonka toteuttaa libatlas3gf-3dnow, libatlas3gf-base, libatlas3gf-sse, libatlas3gf-sse2, libblas3gf
- tai libatlas3gf-base
- Automatically Tuned Linear Algebra Software,generic shared
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- dep: libc6 (>= 2.4)
- Embedded GNU C Library: Shared libraries
myös näennäispaketti, jonka toteuttaa libc6-udeb
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- dep: libcairo2 (>= 1.2.4)
- The Cairo 2D vector graphics library
-
- dep: libfontconfig1 (>= 2.4.0)
- generic font configuration library - runtime
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- dep: libfreetype6 (>= 2.2.1)
- FreeType 2 font engine, shared library files
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- dep: libgcc1 (>= 1:4.1.1)
- GCC support library
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- dep: libgfortran3 (>= 4.3)
- Runtime library for GNU Fortran applications
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- dep: libghemical4
- Molecular Modelling Library
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- dep: libgl1-mesa-glx
- A free implementation of the OpenGL API -- GLX runtime
- tai libgl1
- näennäispaketti, jonka toteuttaa libgl1-mesa-glx, libgl1-mesa-swx11
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- dep: libglade2-0 (>= 1:2.6.1)
- library to load .glade files at runtime
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- dep: libglib2.0-0 (>= 2.12.0)
- The GLib library of C routines
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- dep: libglu1-mesa
- The OpenGL utility library (GLU)
- tai libglu1
- näennäispaketti, jonka toteuttaa libglu1-mesa
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- dep: libgtk2.0-0 (>= 2.16.0)
- The GTK+ graphical user interface library
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- dep: libgtkglext1
- OpenGL Extension to GTK+ (shared libraries)
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- dep: libice6 (>= 1:1.0.0)
- X11 Inter-Client Exchange library
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- dep: liblapack3gf
- library of linear algebra routines 3 - shared version
- tai liblapack.so.3gf
- näennäispaketti, jonka toteuttaa libatlas3gf-3dnow, libatlas3gf-base, libatlas3gf-sse, libatlas3gf-sse2, liblapack3gf
- tai libatlas3gf-base
- Automatically Tuned Linear Algebra Software,generic shared
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- dep: libmopac7-1gf
- Semi-empirical Quantum Chemistry Library (library)
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- dep: liboglappth2
- Oglappth Library
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- dep: libopenbabel3
- Chemical toolbox library
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- dep: libpango1.0-0 (>= 1.14.0)
- Layout and rendering of internationalized text
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- dep: libsc7
- The Scientific Computing Toolkit
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- dep: libsm6
- X11 Session Management library
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- dep: libstdc++6 (>= 4.4.0)
- The GNU Standard C++ Library v3
-
- dep: libx11-6
- X11 client-side library
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- dep: libxml2 (>= 2.6.27)
- GNOME XML library
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- dep: libxmu6
- X11 miscellaneous utility library
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- dep: libxt6
- X11 toolkit intrinsics library
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- dep: mpqc
- The Massively Parallel Quantum Chemistry Program
Imuroi ghemical
| Arkkitehtuuri | Paketin koko | Koko asennettuna | Tiedostot |
|---|---|---|---|
| amd64 | 1,799.0 kt | 2,896.0 kt | [tiedostoluettelo] |
| i386 | 1,792.8 kt | 2,868.0 kt | [tiedostoluettelo] |