[ 原始碼： debian-science ]
套件：science-chemistry（1.14.7）
Debian Science Chemistry packages
This metapackage will install Debian Science packages related to Chemistry. You might also be interested in the field::chemistry debtag and, depending on your focus, in the education-chemistry metapackage.
其他與 science-chemistry 有關的套件
|
|
|
|
-
- dep: science-config (= 1.14.7)
- Debian Science Project config package
-
- dep: science-tasks (= 1.14.7)
- Debian Science tasks for tasksel
-
- rec: adun.app
- Molecular Simulator for GNUstep (GUI)
-
- rec: apbs
- Adaptive Poisson Boltzmann Solver
-
- rec: atomes
- atomic-scale 3D modeling toolbox
-
- rec: avogadro
- Molecular Graphics and Modelling System
-
- rec: bkchem
- Chemical structures editor
-
- rec: bodr
- Blue Obelisk Data Repository
-
- rec: chemeq
- Parser for chemical formula and equilibria
-
- rec: chemical-mime-data
- chemical MIME and file type support for desktops
-
- rec: chemical-structures
- web service providing molecular structures in open formats
-
- rec: chemtool
- chemical structures drawing program
-
- rec: cp2k
- Ab Initio Molecular Dynamics
-
- rec: drawxtl
- crystal structure viewer
-
- rec: easychem
- Draw high-quality molecules and 2D chemical formulas
-
- rec: feff85exafs
- Open Source theoretical EXAFS calculations
-
- rec: gabedit
- graphical user interface to Ab Initio packages
-
- rec: galculator
- scientific calculator
-
- rec: gamgi
- General Atomistic Modelling Graphic Interface (GAMGI)
-
- rec: garlic
- visualization program for biomolecules
-
- rec: gausssum
- parse and display Gaussian, GAMESS, and etc's output
-
- rec: gchempaint
- 2D chemical structures editor for the GNOME2 desktop
-
- rec: gcrystal
- lightweight crystal structures visualizer
-
- rec: gcu-bin
- GNOME chemistry utils (helper applications)
-
- rec: gdis
- molecular and crystal model viewer
-
- rec: gdpc
- visualiser of molecular dynamic simulations
-
- rec: gelemental
- Periodic Table viewer
-
- rec: ghemical
- GNOME molecular modelling environment
-
- rec: gperiodic
- periodic table application
-
- rec: gromacs
- Molecular dynamics simulator, with building and analysis tools
-
- rec: jmol
- Molecular Viewer
-
- rec: kalzium
- periodic table and chemistry tools
-
- rec: katomic
- atomix puzzle game
-
- rec: libcdk-java
- Chemistry Development Kit (CDK) Java libraries
-
- rec: mopac7-bin
- Semi-empirical Quantum Chemistry Library (binaries)
-
- rec: mpqc
- Massively Parallel Quantum Chemistry Program
-
- rec: mpqc-support
- Massively Parallel Quantum Chemistry Program (support tools)
-
- rec: openbabel
- Chemical toolbox utilities (cli)
-
- rec: openfoam
- Open source toolbox for Computational Fluid Dynamics (CFD) - binaries
-
- rec: pdb2pqr
- Preparation of protein structures for electrostatics calculations
-
- rec: psi3
- Quantum Chemical Program Suite
-
- rec: pyfai
- Fast Azimuthal Integration scripts
-
- rec: pymol
- Molecular Graphics System
-
- rec: python3-mpiplus
- Python GPU framework for alchemical free energy calculations (Python 3)
-
- rec: python3-openbabel
- Chemical toolbox library (Python bindings)
-
- rec: python3-pymzml
- mzML mass spectrometric data parsing (Python 3.x)
-
- rec: qutemol
- interactive visualization of macromolecules
-
- rec: rasmol
- visualization of biological macromolecules
-
- rec: tandem-mass
- mass spectrometry software for protein identification
-
- rec: v-sim
- Visualize atomic structures
-
- rec: xbs
- 3-d models and movies of molecules
-
- rec: xdrawchem
- Chemical structures and reactions editor
-
- rec: xmakemol-gl
- program for visualizing atomic and molecular systems (OpenGL)
- 或者 xmakemol
- program for visualizing atomic and molecular systems
-
- sug: fdmnes
- 套件暫時不可用
-
- sug: gcu-plugin
- GNOME chemistry utils (browser plugin)
-
- sug: gdpc-examples
- example files for the gdpc program
-
- sug: gromacs-mpich
- Molecular dynamics sim, binaries for MPICH parallelization
- 或者 gromacs-openmpi
- Molecular dynamics sim, binaries for OpenMPI parallelization
-
- sug: libcoordgen-dev
- 2D coordinate generation for chemical compounds - header files
-
- sug: libegad
- 套件暫時不可用
-
- sug: libint
- 套件暫時不可用
-
- sug: libmaeparser-dev
- Development files to parse Schrödinger Maestro files
-
- sug: libschroedinger-coordgenlibs-dev
- 套件暫時不可用
-
- sug: mmass
- 套件暫時不可用
-
- sug: mmass-modules
- 套件暫時不可用
-
- sug: molden
- 套件暫時不可用
-
- sug: molekel
- 套件暫時不可用
-
- sug: msxpertsuite
- 套件暫時不可用
-
- sug: openchrom
- 套件暫時不可用
-
- sug: python-pymzml-doc
- mzML mass spectrometric data parsing - documentation
-
- sug: python3-amp
- Atomistic Machine-learning Package (python 3)
-
- sug: python3-periodictable
- Extensible periodic table of the elements (Python 3)
-
- sug: refmac-dictionary
- dictionary for macromolecular refinement and model building
-
- sug: tinker
- 套件暫時不可用
-
- sug: viewmol
- 套件暫時不可用