Tag field::chemistry - Chemistry

• apbs - Adaptive Poisson Boltzmann Solver
• atomix - puzzle game for building molecules out of isolated atoms
• atomix-data - architecture independent files for atomix
• boinc-client - core client for the BOINC distributed computing infrastructure
• chemeq - Parser for chemical formula and equilibria
• chemical-mime-data - chemical MIME and file type support for desktops
• chemtool - Chemical structures drawing program
• dict-elements - Data regarding the Elements
• easychem - Draw high-quality molecules and 2D chemical formulas
• education-chemistry - Debian Edu chemistry related applications
• fityk - general-purpose nonlinear curve fitting and data analysis
• garlic - A visualization program for biomolecules
• garlic-doc - [Chemistry] a molecular visualization program - documents
• gausssum - parse and display Gaussian, GAMESS, and etc's output
• gchempaint - 2D chemical structures editor for the GNOME2 desktop
• gcrystal - lightweight crystal structures visualizer
• gdis - molecular and crystal model viewer
• gdpc - visualiser of molecular dynamic simulations
• gdpc-examples - example files for the gdpc program
• ghemical - A GNOME molecular modelling environment
• gperiodic - periodic table application
• gromacs - Molecular dynamics simulator, with building and analysis tools
• gromacs-dev - GROMACS molecular dynamics sim, development kit
• gromacs-lam - Transition package to gromacs-openmpi
• gromacs-mpich - Molecular dynamics sim, binaries for MPICH parallelization
• horae - interactive graphical processing and analysis of EXAFS data
• horae-examples -
• ifeffit - An interactive program for XAFS analysis
• ifrit - a powerful tool for visualizing 3-dimensional data sets
• jsmath - TeX equations in HTML documents
• kalzium - periodic table and chemistry tools for KDE
• kalzium-data - data files for Kalzium
• kst - A KDE application used for displaying scientific data
• kst-bin - A KDE application used for displaying scientific data
• kst-doc - Documentation for the kst application for displaying scientific data
• kst-plugins - Plugins for the kst application for displaying scientific data
• libcdk-java - Chemistry Development Kit (CDK) Java libraries
• libghemical-data - Molecular Modelling Library (data files)
• libghemical3gf -
• libmopac7-1gf - Semi-empirical Quantum Chemistry Library (library)
• libmopac7-dev - Semi-empirical Quantum Chemistry Library (development files)
• liboglappth-dev - Oglappth Library (development files)
• libopenbabel-dev - Chemical toolbox library (development files)
• libopenbabel2 -
• libsc-doc - The Scientific Computing Toolkit (Documentation)
• med-pharmacy - Debian Med packages for pharmaceutical research
• mopac7-bin - Semi-empirical Quantum Chemistry Library (binaries)
• mpqc - The Massively Parallel Quantum Chemistry Program
• mpqc-support - Support programs and tools for MPQC
• openbabel - Chemical toolbox utilities
• openmpi-bin - high performance message passing library -- binaries
• polyxmass -
• polyxmass-bin -
• polyxmass-common -
• polyxmass-data -
• polyxmass-doc -
• psi3 - Quantum Chemical Program Suite
• pymol - Molecular Graphics System
• python-openbabel - Chemical toolbox library (python bindings)
• python-pychart - Python library for creating high quality charts
• rasmol - Visualize biological macromolecules
• rasmol-doc - Documentation for rasmol
• texlive-lang-german - TeX Live: German
• units-filter - Parser for expressions concerning physical values
• viewmol - A graphical front end for computational chemistry programs.
• wims - server for educative contents as courses, exercises, exams
• xbs - 3-d models and movies of molecules
• xdrawchem - Chemical structures and reactions editor
• xmakemol - A program for visualizing atomic and molecular systems
• xmakemol-gl - A program for visualizing atomic and molecular systems (OpenGL)