2 files

CHARMM-DYES: Fluorescent dye parameters for use with the CHARMM forcefield

posted on 2020-07-01, 12:27 authored by Robert Shaw, Tristan Johnston-Wood, Ben Ambrose, Timothy CraggsTimothy Craggs, Grant HillGrant Hill
The residues and parameters that make up the CHARMM-DYES force field, in machine readable GROMACS format. These files are used in molecular dynamics simulations that include the dyes typically used in Förster resonance energy transfer (FRET) experiments.



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The data can be shared openly

Data description

  • The file formats are open or commonly used

Methodology, headings and units

  • There is a readme.txt file describing the methodology, headings and units