[gmx-users] Ligand interaction
ramadavidgroup at gmail.com
Wed Nov 12 07:46:52 CET 2014
Dear md kashif,
my protein energy is
-1.5....e+06 and now after docking with ligand it becomes -1.05....e+06.
what does it mean?
is it is the energy of ligand_protein complex or simply the protein???
In docking generally the receptor is rigid, then why the receptor will
change its energy ?? the energy of receptor,free drug and receptor-drug
With best regards
On Wed, Nov 12, 2014 at 9:57 AM, md kashif <kashifzamir180.mk at gmail.com>
> Hello everyone
> please suggest me that is there any change in protein energy after docking
> the ligand to my energy minimized protein? my protein energy is
> -1.5....e+06 and now after docking with ligand it becomes -1.05....e+06.
> what does it mean?
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