sugar_builder_driver.py Command Help
Command: $SCHRODINGER/run sugar_builder_gui_dir/sugar_builder_driver.py
usage: $SCHRODINGER/run sugar_builder_gui_dir/sugar_builder_driver.py
[-h] [-building_mode {glycosylation,polysaccharide}]
[-glyco_notation GLYCO_NOTATION] [-glyco_graph GLYCO_GRAPH]
[-anchor_amino_acid {Asn,Ser,Thr}] [-minimize]
[-polysaccharide_info POLYSACCHARIDE_INFO] [-length LENGTH]
[-HOST <hostname>] [-D] [-VIEWNAME <viewname>] [-JOBNAME JOBNAME]
Build sugar molecules from monosaccharide units using predefined or custom
definitions. Copyright Schrodinger, LLC. All rights reserved.
options:
-h, -help Show this help message and exit.
-building_mode {glycosylation,polysaccharide}
Build mode deciding the molecule category and input
format. (default: polysaccharide) (default:
polysaccharide)
-glyco_notation GLYCO_NOTATION
IUPAC-condensed glycan notation (e.g.,
"Gal-b1,4-GlcNAc") (default: None)
-glyco_graph GLYCO_GRAPH
JSON file with glycan graph structure (default: None)
-anchor_amino_acid {Asn,Ser,Thr}
Amino acid anchor for glycan attachment (default:
None)
-minimize Minimize the final glycosylation structure. (default:
False)
-polysaccharide_info POLYSACCHARIDE_INFO
Path to JSON file defining the polysaccharide
structure. (default: None)
-length LENGTH Number of repeating units in the polysaccharide chain.
(default: 10)
Job Control Options:
-HOST <hostname> Run job remotely on the indicated host entry.
(default: localhost)
-D, -DEBUG Show details of Job Control operation. (default:
False)
-VIEWNAME <viewname> Specifies viewname used in job filtering in maestro.
(default: False)
-JOBNAME JOBNAME Provide an explicit name for the job. (default: None)