Searched defs:atomnr (Results 1 – 5 of 5) sorted by relevance
/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxpreprocess/ |
H A D | nm2type.cpp | 331 int atomnr = 0; in nm2type() local
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H A D | toppush.cpp | 300 int atomnr; in push_at() local 1293 int atomnr, in push_atom_now() 1393 int cgnumber, atomnr, type, typeB, nscan; in push_atom() local
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/topology/ |
H A D | atoms.h | 110 int atomnr; /* PDB atom number */ member
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/fileio/ |
H A D | pdbio.cpp | 424 int i, j, k, atomnr; in read_anisou() local
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/dports/biology/molden/molden5.8/ |
H A D | xwin.c | 37820 int GetRes(atomnr,iph,opt,Asel) in GetRes() argument 38019 void AddLine(atomnr,activate,Asel,dist,covang,dihang,multip) in AddLine() argument
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