public class EnzymeResidueLocator extends PseudoAtom
PseudoAtom,
Serialized FormIAtomType.Hybridizationcharge, fractionalPoint3d, hydrogenCount, point2d, point3d, stereoParityelectronValency, formalCharge, formalNeighbourCount, hybridizationexactMass, naturalAbundanceatomicNumberAc, Ag, Al, Am, Ar, As, At, Au, B, Ba, Be, Bh, Bi, Bk, Br, C, Ca, Cd, Ce, Cf, Cl, Cm, Cn, Co, Cr, Cs, Cu, Db, Ds, Dy, Er, Es, Eu, F, Fe, Fl, Fm, Fr, Ga, Gd, Ge, H, He, Hf, Hg, Ho, Hs, I, In, Ir, K, Kr, La, Li, Lr, Lu, Lv, Mc, Md, Mg, Mn, Mo, Mt, N, Na, Nb, Nd, Ne, Nh, Ni, No, Np, O, Og, Os, P, Pa, Pb, Pd, Pm, Po, Pr, Pt, Pu, Ra, Rb, Re, Rf, Rg, Rh, Rn, Ru, S, Sb, Sc, Se, Sg, Si, Sm, Sn, Sr, Ta, Tb, Tc, Te, Th, Ti, Tl, Tm, Ts, U, V, W, Wildcard, Xe, Y, Yb, Zn, Zr| Constructor and Description |
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EnzymeResidueLocator(IAtom atom)
Constructs an EnzymeResidueLocator from an existing Atom.
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EnzymeResidueLocator(String label)
Constructs an EnzymeResidueLocator from a String containing the locator.
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clone, getAttachPointNum, getLabel, setAttachPointNum, setLabel, setStereoParity, toStringbonds, compare, equals, getBond, getBondCount, getCharge, getContainer, getFractionalPoint3d, getImplicitHydrogenCount, getIndex, getMapIdx, getPoint2d, getPoint3d, getStereoParity, hashCode, isAromatic, isInRing, setCharge, setFractionalPoint3d, setImplicitHydrogenCount, setIsAromatic, setIsInRing, setMapIdx, setPoint2d, setPoint3dgetAtomTypeName, getBondOrderSum, getCovalentRadius, getFormalCharge, getFormalNeighbourCount, getHybridization, getMaxBondOrder, getValency, setAtomTypeName, setBondOrderSum, setCovalentRadius, setFormalCharge, setFormalNeighbourCount, setHybridization, setMaxBondOrder, setValencygetExactMass, getMassNumber, getNaturalAbundance, setExactMass, setMassNumber, setNaturalAbundancegetAtomicNumber, getSymbol, setAtomicNumber, setSymboladdListener, addProperties, getBuilder, getFlag, getFlags, getFlagValue, getID, getListenerCount, getNotification, getProperties, getProperty, getProperty, notifyChanged, notifyChanged, removeListener, removeProperty, setFlag, setFlags, setID, setNotification, setProperties, setProperty, shallowCopyfinalize, getClass, notify, notifyAll, wait, wait, waitbonds, getBond, getBondCount, getCharge, getContainer, getFractionalPoint3d, getImplicitHydrogenCount, getIndex, getMapIdx, getPoint2d, getPoint3d, getStereoParity, isAromatic, isInRing, setCharge, setFractionalPoint3d, setImplicitHydrogenCount, setIsAromatic, setIsInRing, setMapIdx, setPoint2d, setPoint3dgetAtomTypeName, getBondOrderSum, getCovalentRadius, getFormalCharge, getFormalNeighbourCount, getHybridization, getMaxBondOrder, getValency, setAtomTypeName, setBondOrderSum, setCovalentRadius, setFormalCharge, setFormalNeighbourCount, setHybridization, setMaxBondOrder, setValencygetExactMass, getMassNumber, getNaturalAbundance, setExactMass, setMassNumber, setNaturalAbundancegetAtomicNumber, getSymbol, setAtomicNumber, setSymboladdListener, addProperties, getFlag, getFlags, getFlagValue, getID, getListenerCount, getNotification, getProperties, getProperty, getProperty, notifyChanged, notifyChanged, removeListener, removeProperty, setFlag, setFlags, setID, setNotification, setProperties, setPropertygetBuilderpublic EnzymeResidueLocator(String label)
label - The String describing the residue and its location.public EnzymeResidueLocator(IAtom atom)
atom - Atom that should be converted into a EnzymeResidueLocator.Copyright © 2022. All rights reserved.