CDPL.ForceField.MMFF94VanDerWaalsAtomParameters Class Reference

Inheritance diagram for CDPL.ForceField.MMFF94VanDerWaalsAtomParameters:

Public Member Functions
None	__init__ (MMFF94VanDerWaalsAtomParameters params)
	Initializes a copy of the MMFF94VanDerWaalsAtomParameters instance params. More...
None	__init__ (float atom_pol, float eff_el_num, float fact_a, float fact_g, HDonorAcceptorType don_acc_type)
	Initializes the MMFF94VanDerWaalsAtomParameters instance. More...

Constructor & Destructor Documentation

__init__() [1/2]

None CDPL.ForceField.MMFF94VanDerWaalsAtomParameters.__init__

(

MMFF94VanDerWaalsAtomParameters

params

)

Initializes a copy of the MMFF94VanDerWaalsAtomParameters instance params.

Parameters

params

The MMFF94VanDerWaalsAtomParameters instance to copy.

__init__() [2/2]

None CDPL.ForceField.MMFF94VanDerWaalsAtomParameters.__init__	(	float	atom_pol,
		float	eff_el_num,
		float	fact_a,
		float	fact_g,
		HDonorAcceptorType	don_acc_type
	)

Initializes the MMFF94VanDerWaalsAtomParameters instance.

Parameters

atom_pol
eff_el_num
fact_a
fact_g
don_acc_type