| /dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/externals/pb_s_am/pb_shared/src/ |
| H A D | BaseSys.cpp | 15 vector<double> vdwr, double drot, in BaseMolecule()
26 vector<double> vdwr, vector<Pt> cens, in BaseMolecule()
39 vector<double> vdwr, Pt cen, in BaseMolecule()
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| /dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/externals/pb_s_am/pbam/src/ |
| H A D | SystemAM.cpp | 13 vector<double> vdwr, Pt cen, int type, int typeIdx, in MoleculeAM()
24 vector<Pt> pos, vector<double> vdwr, int type, int typeIdx, in MoleculeAM()
38 vector<double> vdwr, Pt cen, int type, int typeIdx, in MoleculeAM()
51 vector<double> vdwr, int type, int typeIdx, in MoleculeAM()
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| /dports/science/libghemical/libghemical-3.0.0/src/ |
| H A D | atom.h | 63 static const fGL vdwr[ELEMENT_SYMBOLS]; variable
172 f64 vdwr; // important in SF!!! variable
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| H A D | atom.cpp | 154 const fGL element::vdwr[ELEMENT_SYMBOLS] = member in element
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| H A D | eng1_sf.h | 682 f64 * vdwr; variable
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| /dports/biology/molden/molden5.8/ |
| H A D | sillydum.f | 2 & vdwr,cnst,npts1,npts2,iorb,dens) argument
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| H A D | oglbck.c | 108 double *xsym, double *ysym, double *zsym, double *vdwr) in ogwrmol()
507 double *xsym, double *ysym, double *zsym, double *vdwr, in oginid()
540 double *xsym, double *ysym, double *zsym, double *vdwr, in oginsp()
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| H A D | dummyc.c | 34 double *xsym, double *ysym, double *zsym, double *vdwr, in oginsp()
92 double *xsym, double *ysym, double *zsym, double *vdwr) in ogwrmol()
164 double *xsym, double *ysym, double *zsym, double *vdwr, in oginid()
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| H A D | oglmol.c | 74 static double vdwr[] = { variable
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| H A D | actcal.f | 74 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | eucmol.f | 1 subroutine eucmol(vdwr,adjus) argument
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| H A D | plmolp.f | 10 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
565 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
679 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | silly.c | 445 double *xsym, double *ysym, double *zsym, double *vdwr) in ogwrmol()
511 double *xsym, double *ysym, double *zsym, double *vdwr, in ogmol()
2690 double *xsym, double *ysym, double *zsym, double *vdwr, in oginid()
2714 double *xsym, double *ysym, double *zsym, double *vdwr, in oginsp()
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| H A D | plden.f | 9 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | pl3dm.f | 16 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | plvrml.f | 8 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
486 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
622 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
1763 subroutine epvrmd(vdwr,moddma,natoms,norbs,idops,iaton) argument
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| H A D | plpost.f | 12 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | pred.f | 599 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | molden.f | 144 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
7544 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
8204 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
8487 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| H A D | getpoi.f | 870 common /elmcom/ vdwr(mxel),vrad(mxel),icol(mxel) local
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| /dports/devel/gitlab-shell/gitlab-shell-65b8ec55bebd0aea64ac52b9878bafcc2ad992d3/vendor/google.golang.org/appengine/search/ |
| H A D | field.go | 36 // Value is the facet value.
51 type DocumentMetadata struct {
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| /dports/science/vipster/vipster-1.19.1b-14-g7168a1b/vipster/ |
| H A D | periodictable.h | 19 double vdwr; member
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| /dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/externals/pb_s_am/pbsam/src/ |
| H A D | SystemSAM.cpp | 13 vector<Pt> pos, vector<double> vdwr, vector<Pt> cens, in MoleculeSAM()
29 vector<Pt> pos, vector<double> vdwr, vector<Pt> msms_sp, in MoleculeSAM()
45 vector<Pt> pos, vector<double> vdwr, string msms_f, in MoleculeSAM()
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| /dports/science/cdk/cdk-cdk-2.3/descriptor/qsarmolecular/src/main/java/org/openscience/cdk/geometry/surface/ |
| H A D | NumericalSurface.java | 131 double vdwr = PeriodicTable.getVdwRadius(atom.getSymbol()); in init() local
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| /dports/biology/molden/molden5.8/ambfor/ |
| H A D | qvdw.f | 3 & cx,cy,cz,vdwe,vdwr,potq,potv, argument
364 & vdwe,vdwr,potq,potv, argument
687 & vdwe,vdwr,potq,potv, argument
1037 & idoq,idov,vdwe,vdwr,potq,potv, argument
1398 & vdwe,vdwr,potq,potv, argument
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