[gmx-users] About -chainsep and -ter
jiangsl at phys.sinica.edu.tw
Thu Jul 21 18:42:16 CEST 2011
>I suspect this is a bug, so I have filed an issue on redmine:
>In a previous issue (http://redmine.gromacs.org/issues/544), the "-chainsep
>interactive" option did not work, but now it does. Conversely, "-chainsep ter"
>(which should also work in this case) does not.
I get success in pdb2gmx, but I not only delete ter line but also all OXT lines according to this mailing list,
But I'm failed when I used mdrun in "-chainsep ter" case.
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