CheckLol

NAME

CheckLol - check lower limits
SYNOPSIS

CheckLol expr expr
DESCRIPTION

Check all selected lower limits for violation in any of the selected molecules. The command will generate a report with all violations greater than the cutoff given as first argument if it occurs in at least the number of structures given as second argument.

The lower limits do not have to be read/added for all structures, it is enough if they are defined for one structure. If different lower limits are present in different structures, the largest one is considered for the report.

This command supports groups.

EXAMPLE

CheckLol 0.3 1
SEE ALSO

ReadLol, AddLol, Group, RemoveDist, SelectDist

DATE

960317


Reto Koradi, kor@mol.biol.ethz.ch