[gmx-users] trjconv to process multiple types of molecules
y1gao at ucsd.edu
Thu Oct 8 00:32:13 CEST 2009
I have a problem using trjconv to get the trajectory.
I have three types of molecules: MOL, ION, SOL
and I want to convert only 2 types of them, how ever trjconv seems only
accept one input.
I want to keep only MOL and ION, and avoid the large amount of SOL, which
will reduce the analysis a lot.
Any suggestions will be appreciated!
Group 0 ( System) has 14260 elements
Group 1 ( MOL) has 2640 elements
Group 2 ( SOL) has 11580 elements
Group 3 ( ION) has 40 elements
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