python lsub.py -i INPUT [INPUT ...] [-n NODES [NODES ...]] [-x XNODES [XNODES ...]] [-d DISK] [-m MEMORY] [-M MAXMEM] [-t TCHECK] [-p SUBPATH]
This program is used to submit QM jobs onto renlab clusters. Currently it supports gaussian (.com), psi4 (.psi4) and qchem (.qchem) formats. It is very flexible to specify/exclude the required computer nodes.
ssh is used to spread the jobs to CPU nodes. The program will not terminate until all specified jobs have been submitted.
It allows very flexible node selection. Here are several examples:
python lsub.py -i *.com -m 50 -t 30
python lsub.py -i *.com -n node142 node144 -t 30
python lsub.py -i *.com -x node142 node144 -t 30 -m 50