DreamCatcher wrote:
Hello everyone,
I am wondering about the differences between the two precises
version.Can somebody give me some advice about that under what condition
should I take the double precise version and when to choose the other
one? What's the big differences between them? Can I try to install two
different versions on the same computer? Will this operation make any
big bugs? Then how to fix them?
http://www.gromacs.org/Documentation/Terminology/Precision
You can install two versions on the same machine without any problem, just make
sure to use, for example --program-suffix=_d when compiling double precision to
avoid overwriting single-precision executables. For the vast majority of cases,
single precision suffices.
-Justin
Thanks in advance!
celeste
20100326
--
========================================
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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