[gmx-users] Re: g_covar
גדעון לפידות
glapidoth at gmail.com
Tue Aug 16 11:45:10 CEST 2011
Thanks for your replies.
I would like to clarify regarding my first questionn. I don't want a g_dist
matrix. I would like to get a covariance matrix where the values correspond
to absolute distance and not dived into different dimensions. for example
say I have a protein with 100 aa and I run g_covar only on Ca I'll get a
300X300 covariance matrix instead of a 100X100 matrix which is what I want.
is there any built in command in Gromacs that will give me this?
Thanks,
Gideon
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110816/66b5255f/attachment.html>
More information about the gromacs.org_gmx-users
mailing list