Package ffx.potential.bonded

Enum Class RelativeSolvation.SolvationLibrary

java.lang.Object

java.lang.Enum<RelativeSolvation.SolvationLibrary>

ffx.potential.bonded.RelativeSolvation.SolvationLibrary

All Implemented Interfaces:

Serializable, Comparable<RelativeSolvation.SolvationLibrary>, Constable

Enclosing class:

RelativeSolvation

public static enum RelativeSolvation.SolvationLibrary
extends Enum<RelativeSolvation.SolvationLibrary>

Citations: Wolfenden et al: Wolfenden, R., Andersson, L., Cullis, P. M. and Southgate, C. C. B. (1981) AFFINITIES OF AMINO-ACID SIDE-CHAINS FOR SOLVENT WATER. Biochemistry. 20, 849-855

Cabani et al: Cabani, S., Gianni, P., Mollica, V. and Lepori, L. (1981) GROUP CONTRIBUTIONS TO THE THERMODYNAMIC PROPERTIES OF NON-IONIC ORGANIC SOLUTES IN DILUTE AQUEOUS-SOLUTION. Journal of Solution Chemistry. 10, 563-595

MacCallum OPLS libraries: Maccallum, J. L. and Tieleman, D. P. (2003) Calculation of the water-cyclohexane transfer free energies of neutral amino acid side-chain analogs using the OPLS all-atom force field. Journal of Computational Chemistry. 24, 1930-1935

Nested Class Summary

Nested classes/interfaces inherited from class java.lang.Enum

Enum.EnumDesc<E extends Enum<E>>

Enum Constant Summary

Enum Constants

Enum Constant	Description
AUTO
CABANI
EXPLICIT
GK
MACCALLUM_SPC
MACCALLUM_TIP4P
NONE
OPLS_EXPLICIT
OPLS_GK
WOLFENDEN

Method Summary

Modifier and Type	Method	Description
static RelativeSolvation.SolvationLibrary	valueOf(String name)	Returns the enum constant of this class with the specified name.
static RelativeSolvation.SolvationLibrary[]	values()	Returns an array containing the constants of this enum class, in the order they are declared.

Methods inherited from class java.lang.Enum

clone, compareTo, describeConstable, equals, finalize, getDeclaringClass, hashCode, name, ordinal, toString, valueOf

Methods inherited from class java.lang.Object

getClass, notify, notifyAll, wait, wait, wait

Enum Constant Details

WOLFENDEN

public static final RelativeSolvation.SolvationLibrary WOLFENDEN

CABANI

public static final RelativeSolvation.SolvationLibrary CABANI

EXPLICIT

public static final RelativeSolvation.SolvationLibrary EXPLICIT

GK

public static final RelativeSolvation.SolvationLibrary GK

MACCALLUM_SPC

public static final RelativeSolvation.SolvationLibrary MACCALLUM_SPC

MACCALLUM_TIP4P

public static final RelativeSolvation.SolvationLibrary MACCALLUM_TIP4P

OPLS_EXPLICIT

public static final RelativeSolvation.SolvationLibrary OPLS_EXPLICIT

OPLS_GK

public static final RelativeSolvation.SolvationLibrary OPLS_GK

AUTO

public static final RelativeSolvation.SolvationLibrary AUTO

NONE

public static final RelativeSolvation.SolvationLibrary NONE

Method Details

values

public static RelativeSolvation.SolvationLibrary[] values()

Returns an array containing the constants of this enum class, in the order they are declared.

Returns:

an array containing the constants of this enum class, in the order they are declared

valueOf

public static RelativeSolvation.SolvationLibrary valueOf(String name)

Returns the enum constant of this class with the specified name. The string must match exactly an identifier used to declare an enum constant in this class. (Extraneous whitespace characters are not permitted.)

Parameters:

name - the name of the enum constant to be returned.

Returns:

the enum constant with the specified name

Throws:

IllegalArgumentException - if this enum class has no constant with the specified name

NullPointerException - if the argument is null