Searched refs:fileAtoms (Results 1 – 1 of 1) sorted by relevance
| /dports/science/wxmacmolplt/wxmacmolplt-7.7-43-g9a46f7a/src/ |
| H A D | Files.cpp | 1817 long j,ii, nkinds=0, catm, iscanerr=0, LineLength, LinePos=0, fileAtoms=0, in OpenMolPltFile() local
1834 iscanerr = sscanf(&LineText[LinePos], "%1s%ld", token, &fileAtoms); in OpenMolPltFile()
1863 if (fileAtoms <= 0) { /* There don't appear to be any atoms to read in ???*/ in OpenMolPltFile()
1868 if (!MainData->SetupFrameMemory(fileAtoms, fileBonds)) throw MemoryError(); in OpenMolPltFile()
1877 Mode1Vibs = new VibRec(1, fileAtoms); in OpenMolPltFile()
1883 for (j=0; j<fileAtoms; ++j) { // loop over the number of atoms in OpenMolPltFile()
1910 if (((AtomType - 255) < 1)||((AtomType - 255) > fileAtoms)) { in OpenMolPltFile()
1979 VibRec * lVibs = MainData->cFrame->Vibs = new VibRec(nkinds, fileAtoms); in OpenMolPltFile()
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