On 5/16/12 11:30 AM, Andrew DeYoung wrote:
Hi,
I am using the utility g_potential. It takes (among other files) an index
file. At the beginning of the run, it prompts me for a selection from the
index file. Is it possible to make more than one selection, such that the
potential is calculated for each selection, _separately_? If I enter
something like this:
0 3 11
The output seems to only include the potential due to the first selection
("0") and seems to ignore the others.
If you want multiple groups analyzed, you have to invoke g_potential multiple
times, providing the different groups (individually) each time.
-Justin
--
========================================
Justin A. Lemkul, Ph.D.
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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