H-bond Occupancy Gromacs MD trajectory

Shubhandra Tripathi @Shubhandra_Tripathi2

01 January 1970 1 8K Report

This short bash script analyses the H-bond occupancy from Gromacs MD trajectory.

Shubhandra Tripathi

Run the bash file in the folder having trajectory using command :

user$ bash hbond_occupancy.sh

Occupancy Perl Script: http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/scripts.html

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