Hi all,
I made prmtop file through tleap, and tried to run npt simulation.
But it says that there is no SOLVENT_POINTERS.
So I checked and there are no SOLVENT_POINTERS and ATOMS_PER_MOLECULE
sections.
How can I fix it?
Any advice would be grateful.
--
*Junbeom Cho*
Integrated Ph. D. Student
Theoretical and Computational Soft Matters Laboratory
School of Chemical and Biological Engineering
Seoul National University
1, Gwanak-ro, Gwanak-gu, Seoul, 08826, Korea
Tel: +82-2-880-1529
E-mail: cjb0704.snu.ac.kr
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Received on Thu Jan 09 2020 - 21:30:01 PST