Hi Amber users,
I would like to check the continuam water or residence time of water in simulation of protein with ligand in explicit water TIP3P.
If I keep all the water moelcules, then the trajectory becomes much larger for the VMD to visualise. If I remove some water moelcules, the top and crd files not matching.
Any help is much appreciated
Mannan
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Received on Wed Mar 25 2009 - 01:13:10 PDT