[gmx-users] Water tracking along simulation
jalemkul at vt.edu
Mon Oct 16 14:05:22 CEST 2017
On 10/16/17 7:16 AM, Yasser Almeida Hernández wrote:
> Hello everyone,
> It is any tool to track water molecules (or a particle in general)
> along a simulation trajectory, so the final result is the
> pathway/streamline of selected water molecules? It would something
> similar to what was done in this paper
Contact the corresponding author and see how they did what they did.
Justin A. Lemkul, Ph.D.
Virginia Tech Department of Biochemistry
303 Engel Hall
340 West Campus Dr.
Blacksburg, VA 24061
jalemkul at vt.edu | (540) 231-3129
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