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Searched refs:eMolecule (Results 1 – 4 of 4) sorted by relevance

/dports/biology/ncbi-cxx-toolkit/ncbi_cxx--25_2_0/src/app/cn3d/
H A Dstyle_manager.cpp361 nucleotideBackbone.colorScheme = eMolecule; in SetColorScheme()
383 nucleotideBackbone.colorScheme = eMolecule; in SetColorScheme()
406 proteinBackbone.colorScheme = eMolecule; in SetColorScheme()
407 nucleotideBackbone.colorScheme = eMolecule; in SetColorScheme()
409 heterogens.colorScheme = solvents.colorScheme = eMolecule; in SetColorScheme()
410 helixObjects.colorScheme = strandObjects.colorScheme = eMolecule; in SetColorScheme()
418 heterogens.colorScheme = solvents.colorScheme = eMolecule; in SetColorScheme()
419 helixObjects.colorScheme = strandObjects.colorScheme = eMolecule; in SetColorScheme()
432 nucleotideBackbone.colorScheme = eMolecule; in SetColorScheme()
758 case StyleSettings::eMolecule: in GetAtomStyle()
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H A Dstyle_manager.hpp99 eMolecule = 3, enumerator
H A Dstyle_dialog.cpp224 ColorSchemeStrings.Associate(StyleSettings::eMolecule, "Molecule"); in SetupStyleStrings()
/dports/science/openbabel/openbabel-3.1.1/src/
H A Dmcdlutil.cpp3986 std::vector<int> bList(eMolecule.nAtoms(), 0); in addFragment()
3988 for (i=0; i<eMolecule.nBonds(); i++) { in addFragment()
3989 n1=eMolecule.getBond(i)->at[0]; in addFragment()
3990 n2=eMolecule.getBond(i)->at[1]; in addFragment()
3993 emBLength=emBLength+eMolecule.bondLength(i); in addFragment()
4006 k1=eMolecule.getBond(chb1)->at[0]; in addFragment()
4007 k2=eMolecule.getBond(chb1)->at[1]; in addFragment()
4031 r1=eMolecule.getAtom(list[i])->rx-xOldCenter; in addFragment()
4032 r2=eMolecule.getAtom(list[i])->ry-yOldCenter; in addFragment()
4035 sa=eMolecule.getAtom(list[i])->clone(); in addFragment()
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