Dear All,
I ran an antichanber and tleap for the carboxylic acid salt of single
ligand molecules. Further I want to simulate the single ligand molecules in
AMBER.
But the system is not able to open the Partial_mini.rst, Full_Minu.rst,
Heating.rst and equil.rst for MD.
I have attached all the scripts for your kind attention. I request you to
kindly help me in this regard.
Thanks & regards
*Dr. Ramesh M*
Email: shreeramesh.gmail.com
Mobile: 91 + (0) 9646469938 27+ (0) 844556164
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- application/octet-stream attachment: equil.in
- application/octet-stream attachment: md.in
- application/octet-stream attachment: tleap.all
Received on Mon Feb 02 2015 - 07:00:06 PST
