[gmx-users] pulling more groups
Mario Orsi
kurtz219 at yahoo.it
Mon Mar 15 16:28:01 CET 2004
Hi Robert and all,
I've also tried to pull more than one group with
version 3.2, it doesn't work as well... maybe there is
a bug.
--- Robert Vacha <vachr9am at port.kolej.mff.cuni.cz> ha
scritto: > Hi,
>
> I try pulled two groups in version 3.2.1 but it
> seams that pulled is
> only first one and second one is not effected. Am I
> doing anything
> wrong?
>
> Regards,
> Robert Vacha
>
> pull.ppa- in this case G1 is moving and G3 stays.:
> runtype = afm
> group_1 = G1
> group_2 = G3
> reference_group = G2
> reftype = com_t0
> reflag = 1
> pulldim = N N Y
> r = 10
> rc = 20
> update = 1
> afm_rate1 = 0.1
> afm_rate2 = 0.1
> afm_k1 = 100000
> afm_k2 = 100000
> afm_init1 = 0.0 0.0 -5.0
> afm_init2 = 0.0 0.0 5.0
>
>
> second pull.ppa- I switched the order of groups to
> be pulled
> and in this case G3 is moving and G1 stays. :
> runtype = afm
> group_1 = G3
> group_2 = G1
> reference_group = G2
> reftype = com_t0
> reflag = 1
> pulldim = N N Y
> r = 10
> rc = 20
> update = 1
> afm_rate1 = 0.1
> afm_rate2 = 0.1
> afm_k1 = 100000
> afm_k2 = 100000
> afm_init1 = 0.0 0.0 5.0
> afm_init2 = 0.0 0.0 -5.0
>
>
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