[gmx-users] cmaptypes format

Marcelo Depólo marcelodepolo at gmail.com
Wed Jan 15 20:39:10 CET 2020


Hi everyone!

I was wondering about the cmaptypes format within cmap.itp file.

[ cmaptypes ]
C N CT C N 1 24 24\

I understand that C-N-CT-C = phi, N-CT-C-N = psi and 24x24 is the grid
size. What does this '1' mean?

Thanks in advance!
--
Marcelo Depólo Polêto
Postdoctoral Researcher
BIOAGRO - Room T07
Department of General Biology - UFV
Contact: + 55 31 3612-2464


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