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Next: Requirements Up: Planarity Restraints Previous: Planarity Restraints

Syntax

RESTraints PLANar { $<$restraints-planar-statement$>$ } END
is invoked from the main level of X-PLOR.
$<$restraints-planar-statement$>$:==
GROUp
{ $<$restraints-plane-group-statement$>$ } END adds a new group to the planar restraints database. More than three atoms per group need to be defined (default: (NOT ALL)).
INITialize
erases the current planar restraints database.
$<$restraints-plane-group-statement$>$:==
SELEction=$<$selection$>$
defines the group of atoms that are restrained to form a plane (default: ( NOT ALL)).
WEIGht=$<$real$>$
specifies a weight $w_{plan}$ for the planarity restraint in kcal mole$^{-1}$ Å$^{-2}$ (default: 300.0 kcal mole$^{-1}$ Å$^{-2}$).

Xplor-NIH 2025-03-21