Tasks page

This is a list of the Tasks DebiChem is made of:

Cheminformatics - DebiChem Cheminformatics

This metapackage will install cheminformatics packages useful for chemists.

Crystallography - DebiChem crystallography

This metapackage will install packages for crystallography which might be useful for chemists.

Molecular modelling - DebiChem 3D Molecular Modelling and Visualization

This metapackage will install 3D Molecular Modelling and Visualization which might be useful for chemists.

Molecular ab initio calculations - DebiChem Molecular Ab Initio Calculations

This metapackage will install packages doing molecular ab initio calculations which might be useful for chemists.

Molecular dynamics - DebiChem Molecular Dynamics

This metapackage will install packages for running or analyzing both classical and ab initio molecular dynamics simulations which might be useful for chemists.

Periodic ab initio calculations - DebiChem Periodic ab Initio Calculations

This metapackage will install packages doing periodic ab initio calculations which might be useful for chemists.

Polymer editors and mass spectrometry - DebiChem polymer sequence editors and mass spectrometry

This metapackage will install packages which enable you to edit polymer sequences so as to perform mass spectrometry simulations and view mass spectra.

Semi empirical calculations - DebiChem Semi Empirical

This metapackage will install Semi Empirical which might be useful for chemists.

2d structure editors - DebiChem 2D structure editors

This metapackage will install 2D structure editors which might be useful for chemists.

Output & visualization - DebiChem 3D Viewers and Calculation Output Visualization

This metapackage will install 3D Viewers and Calculation Output Visualization which might be useful for chemists.