On 4/21/20 8:07 AM, Shashank Ranjan Srivastava wrote:
Thank you so much Prof. Lemkul for your reply.
As I don't know what and how to use this pull code, if you have any idea
regarding what you have suggested will be of great help to me.
Meanwhile I will read more about it.
General principles here: http://www.mdtutorials.com/gmx/umbrella/index.html
Obviously that's a very different approach from what you're trying to do
but you can learn the basic syntax there.
Justin A. Lemkul, Ph.D.
Office: 301 Fralin Hall
Lab: 303 Engel Hall
Virginia Tech Department of Biochemistry
340 West Campus Dr.
Blacksburg, VA 24061
jalem...@vt.edu | (540) 231-3129
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