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[ Källkod: mpqc  ]

Paket: mpqc-support (2.3.1-14)

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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.

Märken: Field: Chemistry, Physics, Implemented in: implemented-in::perl, interface::commandline, User Interface: X Window System, Role: Program, Scope: scope::utility, suite::emacs, Interface Toolkit: Tk, X Window System: Application

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