Dear All,Is there any command in cpptraj through which we can explore the role of any particular active side residue in complex stability during protein ligand MD simulation. Best Regards, Saman Yousuf AliJunior Research Fellow,
| Lab No. P-133, Computational Chemistry Laboratory
Dr. Panjwani Center for Molecular Medicine & Drug Research,
International Center for Chemical & Biological Sciences,
University of Karachi – 75270.Karachi-Pakistan.
Contact No:
Office (92-21) 111222292 (Ext 309)
Email ID:
saman.yousufali64.yahoo.com
saman.ali.iccs.edu
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Received on Thu Oct 20 2016 - 21:30:03 PDT
