[gmx-users] GROMACS command for energy calculation

Acoot Brett acootbrett at yahoo.com
Sun Aug 26 23:02:41 CEST 2012


Dear All,
 
After the production MD has been done, does GROMACS has a command which can calculate the interaction energy between any 2 residues in a frame of structure from the MD?
 
Cheers,
 
Acoot  



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