Chemical Data Processing Library Python API - Version 1.1.1
CDPL.ForceField.UFFAtomTypePropertyTable Member List

This is the complete list of members for CDPL.ForceField.UFFAtomTypePropertyTable, including all inherited members.

__init__()CDPL.ForceField.UFFAtomTypePropertyTable
__init__(UFFAtomTypePropertyTable table)CDPL.ForceField.UFFAtomTypePropertyTable
addEntry(int atom_type, str atom_type_sym, int atomic_no, float bond_rad, float bond_ang, float vdw_dist, float vdw_energy, float vdw_scale, float eff_charge)CDPL.ForceField.UFFAtomTypePropertyTable
assign(UFFAtomTypePropertyTable table)CDPL.ForceField.UFFAtomTypePropertyTable
clear() (defined in CDPL.ForceField.UFFAtomTypePropertyTable)CDPL.ForceField.UFFAtomTypePropertyTable
entries (defined in CDPL.ForceField.UFFAtomTypePropertyTable)CDPL.ForceField.UFFAtomTypePropertyTablestatic
get()CDPL.ForceField.UFFAtomTypePropertyTablestatic
getEntries()CDPL.ForceField.UFFAtomTypePropertyTable
getEntry(int atom_type)CDPL.ForceField.UFFAtomTypePropertyTable
getNumEntries()CDPL.ForceField.UFFAtomTypePropertyTable
getObjectID()CDPL.ForceField.UFFAtomTypePropertyTable
loadDefaults() (defined in CDPL.ForceField.UFFAtomTypePropertyTable)CDPL.ForceField.UFFAtomTypePropertyTable
numEntries (defined in CDPL.ForceField.UFFAtomTypePropertyTable)CDPL.ForceField.UFFAtomTypePropertyTablestatic
objectID (defined in CDPL.ForceField.UFFAtomTypePropertyTable)CDPL.ForceField.UFFAtomTypePropertyTablestatic
removeEntry(int atom_type)CDPL.ForceField.UFFAtomTypePropertyTable
set(UFFAtomTypePropertyTable table)CDPL.ForceField.UFFAtomTypePropertyTablestatic