Optional Parameters¶
-
-append
<bool>
¶ Option to append to current loop dictionary with additional structures, otherwise will fail if output DB exists
[default = false]
-
-title
<title>
¶ Title of the added structures, e.g. “Loops of aspartic acid protease structures”
[default = LoopTemplateDatabase]
-
-source_date
<value>
¶ Date the source was updated in the format MM-DD-YYYY. Defaults to today’s date.
-
-added_date
<value>
¶ Date the files were added to the DB in the format MM-DD-YYYY. Defaults to today’s date.
-
-ncpu
<value>
¶ Number of processors to run with, 0 means all available.
[default = 0]
-
-max_length
<value>
¶ Max length of loops to add to the database. Note to add a buffer for necessary crop back in loop modeling
[default = 22]
-
-crop_length
<value>
¶ Crop back this number of residues at the termini/breaks for each structure being evaluated
[default = 2]
-
-exclude_reg_ss
<value>
¶ Exclude sections with >75% regular secondary structures like helices and strand/sheets.
[default = true]
-
-prefix
<prefix>
¶ Prefix used to name output files, default is blank
[default = “loopdb”]
-
-log
<logfile>
¶ The argument for this flag specifies the name of the log file. This overrides any specified prefix.
-
-settings
<settingsfile>
¶ The argument for this flag specifies the name of the settings file. This overrides any specified prefix.
-
-verbose
:
¶ Triggers copious logging output
[default = false]