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PyMOlyze

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Description

PyMOlyze is a graphical program to analyze the results of quantum chemistry (HF/DFT) calculations. Features include various population analyses, fragment analysis, monitoring structures during an optimization, and a simple, but powerful, XYZ editor.

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Additional Project Details

Languages

English

Intended Audience

Science/Research

User Interface

Qt

Programming Language

C++, Python

Registered

2006-01-18

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