[gmx-users] water mediated Hbond

spss4 at iacs.res.in spss4 at iacs.res.in
Tue May 7 09:10:11 CEST 2019


Dear all
I want to determine the water mediated hydrogen between DNA bases and  
small molecule. What extra flag should I use in gmx hbond command? Is  
there any other option to capture the water mediated Hbonds? Please  
suggest something.
Sunipa Sarkar


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