#!/bin/csh #Q ETIME = 600 Estimated time of job #Q NPROCS = 16 Requested number of processors #Q CONF = 90 Percent confidence in time estimate #Q TPIP = 2 Number of job streams per IP address (typically 2) # white space is required between #Q keywords, equal sign and value # # user commands go here /v/charmm/charmmc26n1 < charmm.input > charmm.output #