Molly—a fast reader and writer for the XTC file format

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Authors

M. S. S. Westendorp · University of Groningen

Tsjerk A. Wassenaar · University of Groningen

Abstract

A fast reader and writer for the Gromacs xtc file format implemented in pure Rust. Features selective frame and atom reading, buffered I/O, and Python bindings.

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Publication Details

Published in: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.18902574

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Molly—a fast reader and writer for the XTC file format

Authors

Abstract

Topics & Keywords

Publication Details