csp.py Command Help
Command: $SCHRODINGER/run -FROM scisol csp/csp.py
usage: csp.py [-h] [-debug]
(-config CONFIG_FILE_NAME | -write-default-config WRITE_DEFAULT_CONFIG)
[-GPUHOST GPUHOST] [--pipeline-options PIPELINE_OPTIONS]
Script to run the full CSP workflow under job control. Generate default config
YAML: $SCHRODINGER/run -FROM scisol csp/csp.py -write-default-config
<config.yaml> Run workflow: $SCHRODINGER/run -FROM scisol csp/csp.py
config.yaml -HOST <host> -SUBHOST <subhost> -GPUHOST <gpuhost>
options:
-h, --help show this help message and exit
-debug Write debug files
-config CONFIG_FILE_NAME
configuration file name
-write-default-config WRITE_DEFAULT_CONFIG
Output default config file which can subsequently be
altered to specify user settings.
-GPUHOST GPUHOST GPU subhost on which to run the multisim jobs. Format
as <gpu_host>:<n> where <n> is the maximum amount of
gpu workers.
--pipeline-options PIPELINE_OPTIONS
Custom pipeline options to pass to the SeamRunner.