[gmx-users] Different temperature of protein`s patch

w.j.schravendijk at students.pharm.uu.nl w.j.schravendijk at students.pharm.uu.nl
Mon Feb 25 14:18:48 CET 2002

On Sun, 24 Feb 2002, alexander yakovenko wrote:

> Is it possible to calculate dynamic of protein with different
> temperature of it's aminoacids?

I guess you can assign various residues for tc_groups and define different
temperatures for them. You'll first have to index the residues with
make_ndx, though.

Greetings, Pim

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