schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge module¶
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schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge.
merge_rules
(file1, file2)¶
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schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge.
merge_lists
(file1, file2)¶ Load two files, concatenate the two lists, and store result in file1. If file1 does not exist initially, then a simple copy is made. file1 = generally the built-in force field file2 = takes precedence in case of conflicts; generally the new force field
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schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge.
update_templates
(templates, filename)¶
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schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge.
update_templates_strict
(templates, filename)¶
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schrodinger.application.desmond.packages.viparr1.viparr.viparr_merge.
merge
(dir1, dir2)¶ Merge force fields in directories dir1 and dir2 and return name of directory with merged force field. dir1 = generally the built-in force field dir2 = takes precedence in case of conflicts; generally the new force field