TrivalentAtom Class Reference

#include <Compound.h>

Inheritance diagram for TrivalentAtom:

List of all members.

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Detailed Description

Base class for atoms having exactly three covalent bonds.

Initial default configuration is planar. Bond centers are named "bond1", "bond2", and "bond3"

Public Member Functions
	TrivalentAtom (const Compound::AtomName &atomName, const Element &element, Angle angle1=120 *Deg2Rad, Angle angle2=120 *Deg2Rad)

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Constructor & Destructor Documentation

TrivalentAtom	(	const Compound::AtomName &	atomName,
		const Element &	element,
		Angle	angle1 = 120*Deg2Rad,
		Angle	angle2 = 120*Deg2Rad
	)			[inline]

Parameters:

atomName	name for new atom
element	chemical element for new atom
angle1	angle between first and second BondCenters
angle2	angle between first and third BondCenters

References Compound::addFirstBondCenter(), Compound::addPlanarBondCenter(), Compound::addSecondBondCenter(), Compound::setCompoundName(), and Compound::setInboardBondCenter().

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The documentation for this class was generated from the following file:

• Compound.h