Dear Gmx Users,
My system consists of 10 ligands and protein. I am calculating the hydrogen
bonds between each residue and my ligands (LIG). The overall charge of each
ligand is zero.
I used:
g_hbond -f md2.trr -s md2.tpr -n SystemGRP.ndx -num
RESIDUEwithLigandsHbond.xvg
And I found one residue
On 31/10/2011 10:19 PM, Steven Neumann wrote:
Dear Gmx Users,
My system consists of 10 ligands and protein. I am calculating the
hydrogen bonds between each residue and my ligands (LIG). The overall
charge of each ligand is zero.
I used:
g_hbond -f md2.trr -s md2.tpr -n SystemGRP.ndx -num
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