[gmx-users] Re: trr and xtc
Vitaly V. Chaban
vvchaban at gmail.com
Wed Jul 22 18:29:24 CEST 2009
Jamie,
To have a trajectory in TRR you should just change
>
> nstxout=0
> nstvout=0
>
>
to non-zeros.
--
Vitaly V. Chaban, Ph.D. (ABD)
School of Chemistry
V.N. Karazin Kharkiv National University
Svoboda sq.,4, Kharkiv 61077, Ukraine
email: chaban at univer.kharkov.ua,vvchaban at gmail.com
skype: vvchaban, mob.: +38-097-8259698
http://www-rmn.univer.kharkov.ua/chaban.html
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