Re: [AMBER] ptraj clustering error

From: Thomas Cheatham III <tec3.utah.edu>
Date: Fri, 7 Oct 2011 13:25:16 -0600 (Mountain Daylight Time)

> trajin ../prod1.mdcrd 5001 10000
> cluster out testcluster representive pdb \
> average pdb averagelinkage clusters 5 rms .P,O3',O5',C3',C4',C5'
...
> PTRAJ: cluster out testcluster representive pdb average pdb
> averagelinkage clusters 5 rms .P
> MASK = representive

representive -> representative

--tec3

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Fri Oct 07 2011 - 12:30:06 PDT
Custom Search