Hi guys, Charles,
So e.g. in: xplor-nih-2.27/eginput/gb1_rdc/.runAll
the command:
xplor -quick -py -parallel anneal.py
should already use multiple cores?
It doesn't inside my Ubuntu virtual machine with 4 cores. Should I mention
the -smp 4 to xplor or add another setting somewhere? I don't see how the
class StructureLoop can be instructed to take advantage. Below I've tried
with an environment setting.
We're trying to run a little faster today...
Cheers,
Jurgen
Some tests:
iLvc/~/ echo $XPLOR_NUM_PROCESSES
4
iLvc/~/ xplor -py
Xplor-NIH version 2.27
C.D. Schwieters, J.J. Kuszewski, Progr. NMR Spectr. 48, 47-62
(2006).
N. Tjandra, and G.M. Clore J. Magn. Res., 160, 66-74 (2003).
http://nmr.cit.nih.gov/xplor-nih based on X-PLOR 3.851 by A.T.
Brunger
User: i on: vc (x86/Linux ) at: 28-Oct-11 16:27:08
No entry for terminal type "xterm";
using dumb terminal settings.
python> import xplor
python> xplor.p_numProcs
1
-------------- next part --------------
An HTML attachment was scrubbed...
URL:
http://dcb.cit.nih.gov/pipermail/xplor-nih/attachments/20111028/d7b47167/attachment.html
