RE: NAMD in TACC lonestar

From: Song, Hyundeok (songhk) (
Date: Mon Mar 29 2010 - 11:42:32 CDT

NAMD in TACC lonestar

;job submission file, configuration file, log file, number of node
*****.pbs *****.conf *****.log 128

.pbs file contains following line.
bsub -q ${QUEUE} -J ***** -W ${TIME} -n ${NUMPROCS} -P ************ << ENDINPUT

From: [] on behalf of snoze pa []
Sent: Monday, March 29, 2010 11:51 AM
Subject: namd-l: NAMD in TACC lonestar

Dear NAMD developers,

 Does anyone know how to run a namd2 job in TACC lonestar. Is it
possible to run local version of NAMD2 there using bsub.

Thank you,

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