[gmx-users] g_rdf

politr at fh.huji.ac.il politr at fh.huji.ac.il
Tue Mar 16 12:31:09 CET 2010


Dear gromacs users,

I want to calculate radial distribution function around my protein. I  
want to get g_rdf for water molecules (OW) around my protein and g_rdf  
for COM of some solutes around my protein. The numbers should be  
averaged over all the frames. I tried to look at the mailing list but  
there is some error and as a result I can't open it. Can someone help  
me with it and give me the command I should use.
Regina


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