[gmx-users] Combined essential dynamics analysis
Ruben Martinez Buey
ruben at akilonia.cib.csic.es
Wed Jul 16 16:12:01 CEST 2003
> Dear Bert,
Thanks a lot four reply.
> >
> > Average projection (mean):
> > eigenvec 1: -0.365220 0.457450
> > eigenvec 2: 0.137630 -0.169460
> > eigenvec 3: 0.137790 -0.319940
> > eigenvec 4: 0.068647 -0.078291
> > eigenvec 5: 0.087228 0.040858
>
> hmm, I suppose the two trajectories had a different length? Since
> otherwise the projections should be symmetrical with respect to zero.
> ( ie -0.3 0.3 etc)
They must be exactly symmetrical with respect to zero?
I mean -0.40976 and 0.41711 for example is right?
I´ve generated 500 structures in each run with CONCOORD, and then just merged them.
Thanks a lot again four your help
Regards,
Ruben
>
>
> Bert
>
> ____________________________________________________________________________
> Dr. Bert de Groot
>
> Max Planck Institute for Biophysical Chemistry
> Theoretical molecular biophysics group
> Am Fassberg 11
> 37077 Goettingen, Germany
>
> tel: +49-551-2011306, fax: +49-551-2011089
>
> email: bgroot at gwdg.de
> http://www.mpibpc.gwdg.de/abteilungen/071/bgroot
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--
___________________________________________
Rubén Martínez-Buey. PhD student
Protein Function and Structure Dept. Lab. 352
Centro de Investigaciones Biológicas (CIB-CSIC)
C/ Velázquez, 144, 28006 MADRID (SPAIN)
Tlf: +34-91-561 18 00 ext. 4380
Fax: +34-91-562 75 18
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