Hi everyone,
This is my first post to this forum and I am grateful to be a part of it!
I am relatively new to Amber as well. Sorry if this post goes over material
that someone else has posted before. I have looked as far as I could and I
did not find an exact match on what I am looking to do.
So without going into the entire project,
I would like to run simulations in vacuo using spherical flatwell
potentials.
I am not sure how to implement this - however this article has implemented
the method (this paper is similar to my work - and the method will greatly
help my work)
http://pubs.acs.org/doi/abs/10.1021/jp501503x
Any help in setting this up would be very much appreciated - I am still
trying to decipher what section 24.1 means in the Amber doc. Please let me
know any details that are needed from me in order to progress.
I greatly appreciate any and all help!
Thank you!
With gratitude,
~Kenneth
Kenneth N. McGuinness Ph.D
Research Associate
Advanced Science Research Center CUNY
Adviser: Dr. Rein Ulijn <http://www.ulijnlab.com/>
Cell: 928-925-7693
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Received on Mon Apr 04 2016 - 11:30:04 PDT
