[gmx-users] Regarding MKTOP
Ravi Kumar Venkatraman
ravikumarvenkatraman at gmail.com
Sat Oct 8 15:54:22 CEST 2011
I have been using MKTOP for generating topologies for Amber and
OPLSAA ff. I was trying to generate CCL4 topology in both OPLSAA and AMBER
ff but Its not identifing the chlorine atoms and hence it couldn't generate
bond stretching, bending parametrs.
Please help sort this problem.
Thank you in advance.
Ravi Kumar Venkatraman,
IPC Dept., IISc,
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