water gro file creation/generator in MATLAB

Versione 1.1.0.0 (1,98 KB) da Sumith YD
gromacs *.gro file creator for a rectangular block of water
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Aggiornato 31 gen 2015

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This code generates water.gro which contains water molecules in the gromacs supported format with user specified dimensions. User can also offset the water to a particular location by offset variables.

Cita come

Sumith YD (2024). water gro file creation/generator in MATLAB (https://www.mathworks.com/matlabcentral/fileexchange/47977-water-gro-file-creation-generator-in-matlab), MATLAB Central File Exchange. Recuperato .

Compatibilità della release di MATLAB
Creato con R2013a
Compatibile con qualsiasi release
Compatibilità della piattaforma
Windows macOS Linux
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Versione Pubblicato Note della release
1.1.0.0

This version is updated after removing minor bugs which prevented bulk water of sizes above 25nm.
1.0.0.0