Re: [AMBER] (no subject)

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Sat, 6 Nov 2010 19:15:41 -0700

> program that generate statistics of the computed structures

See the manual for 'ptraj'.

> deviations from the ideal covalent geometry (bonds angles and dihedral

ptraj, and you may want to measure fitted rms from a reference


AMBER mailing list
Received on Sat Nov 06 2010 - 19:30:05 PDT
Custom Search