Package org.jmol.minimize.forcefield

Class AtomType

java.lang.Object

org.jmol.minimize.forcefield.AtomType

public class AtomType
extends Object

Field Summary

Fields

Modifier and Type	Field	Description
(package private) boolean	arom
(package private) String	descr
(package private) int	elemNo
(package private) float	fcadj
(package private) float	formalCharge
(package private) int	hType
(package private) int	mltb
(package private) int	mmType
(package private) boolean	pilp
(package private) boolean	sbmb
(package private) String	smartsCode
(package private) int	val

Constructor Summary

Constructors

Constructor	Description
AtomType(int elemNo, int mmType, int hType, float formalCharge, int val, String descr, String smartsCode)

Method Summary

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Field Detail

elemNo

int elemNo

descr

String descr

smartsCode

String smartsCode

mmType

int mmType

hType

int hType

formalCharge

float formalCharge

fcadj

float fcadj

sbmb

boolean sbmb

arom

boolean arom

pilp

boolean pilp

mltb

int mltb

val

int val

Constructor Detail

AtomType

AtomType(int elemNo,
         int mmType,
         int hType,
         float formalCharge,
         int val,
         String descr,
         String smartsCode)