Dear AMber
I am trying to calculate the multiple specific hbond in the single run.
How to give the syntax ?
For example
hbond MyHB distance 3.5 angle 135 :1,78 out 178xnhb.dat avgout
178xavghb.dat nointramol series
hbond MyHB distance 3.5 angle 135 :3,78 out 378xnhb.dat avgout
378xavghb.dat nointramol series
When I give like this the script is not running
Any help is appreciated !
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Received on Mon Feb 14 2022 - 09:30:02 PST
