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[ Source: mpqc  ]

Package: mpqc-support (2.3.1-22)

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Massively Parallel Quantum Chemistry Program (support tools)

MPQC is an ab-inito quantum chemistry program. It is especially designed to compute molecules in a highly parallelized fashion.

This package includes Perl modules to parse the output, Emacs-modes to facilitate editing mpqc files and molrender, a program to output the molecules in OOGL-format.

Tags: Field: Chemistry, Physics, Implemented in: implemented-in::perl, interface::commandline, User Interface: Graphical User Interface, interface::x11, role::program, Scope: Utility, Application Suite: Emacs, Interface Toolkit: uitoolkit::tk, x11::application

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Architecture Package Size Installed Size Files
amd64 572.3 kB16,367.0 kB [list of files]