[gmx-developers] CVS implementation of REMD

Anton Feenstra feenstra at few.vu.nl
Wed May 25 17:19:04 CEST 2005


Ken Rotondi wrote:
> Then I ran mdrun:
> 
> mdrun -v -multi -np 2 -replex 20 -s topol.tpr

Perhaps -np 2 and -replex 20 'bite' each other. From what I gather from 
the other mails, 'mdrun -v -multi -replex 2' could work.

-- 
Groetjes,

Anton

* NOTE: New Phone & Fax numbers (below) *

  _____________ _______________________________________________________
|             |                                                       |
|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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| \_/ \_/ | | | Tel: +31 20 59 87608 - Fax: +31 20 59 87610           |
|             | Feenstra at few.vu.nl - www.few.vu.nl/~feenstra/         |
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