[gmx-users] hbond between backbone atoms
Ming Tang
m21.tang at qut.edu.au
Tue Jun 28 12:41:46 CEST 2016
Dear list,
I want to calculate hbond between backbone atoms on different chains of my protein only. but when it give me this error "nothing to be none".
I used this command: gxm hbond -f traj.trr -s topol.tpr -num hbnum.xvg -a 30 -r 0.5
I can use this command to get hbond between protein and protein.
Can anybody give me some suggestions?
Thank you
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