AMBER Archive (2004)

Subject: AMBER: residence time

From: Ioana Cozmuta (ioana_at_nas.nasa.gov)
Date: Tue Mar 23 2004 - 21:51:10 CST

Hello,

Is there a standard procedure to calculate residence times of ions around
certain amino acids from MD trajectories? Does anyone have a script
already written to do that? Or is it up to each individual how to define
and calculate such a quantity?

Thank you,
Ioana

******************
Ioana Cozmuta, PhD
Research Scientist Eloret Corporation
Mail Stop 230-3
NASA AMES Research Center
Moffet Field, CA 94035-1000
Phone: (650) 604-0993
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu