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Searched refs:BondNum (Results 1 – 3 of 3) sorted by relevance

/dports/science/wxmacmolplt/wxmacmolplt-7.7-43-g9a46f7a/src/
H A DFrame.h130 void DeleteBond(long BondNum);
163 …inline bool GetBondSelectState(long BondNum) const {return ((BondNum<NumBonds)?Bonds[BondNum].GetS… in GetBondSelectState() argument
164 inline void SetBondSelectState(long BondNum, bool state) in SetBondSelectState() argument
165 {if (BondNum<NumBonds) Bonds[BondNum].SetSelectState(state);}; in SetBondSelectState()
166 inline BondOrder GetBondOrder(long BondNum) const {return Bonds[BondNum].Order;}; in GetBondOrder() argument
168 inline void SetBondOrder(long BondNum, BondOrder NewOrder) {Bonds[BondNum].Order = NewOrder;}; in SetBondOrder() argument
H A DFrame.cpp460 void Frame::DeleteBond(long BondNum) { in DeleteBond() argument
461 if (BondNum < NumBonds) { in DeleteBond()
463 for (long i=BondNum; i<NumBonds; i++) { in DeleteBond()
/dports/science/py-pymol/pymol-open-source-2.4.0/contrib/uiuc/plugins/molfile_plugin/src/
H A DReadPARM.h73 *BondNum, *AngleHAt1, *AngleHAt2, *AngleHAt3, *AngleHNum, member
395 prm->BondNum = (int *) get(sizeof(int)* prm->Nbona); in readparm()
611 &prm->BondAt1[i], &prm->BondAt2[i], &prm->BondNum[i]); in readparm()
620 prm->BondNum[i] = buffer[3*i+2]; in readparm()