Chih-Ying Lin wrote:
Hi
The command
g_sas =>
Select a group for calculation of surface and a group for output
What is the difference between "a group for calculation of surface" and
"a group for output"?
Please consult the documentation. From g_sas -h:
"The program will ask for a group for the surface calculation and a group for
the output. The calculation group should always consists of all the non-solvent
atoms in the system. The output group can be the whole or part of the
calculation group."
-Justin
Thank you
Lin
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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