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Searched refs:spgr (Results 1 – 25 of 51) sorted by relevance

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/dports/science/clipper/clipper-2.1/examples/
H A Dc2test.cpp8 clipper::Spacegroup spgr = mtzin.spacegroup(); in c1() local
11 clipper::HKL_info myhkl( spgr, cell, reso, true ); // init hkls in c1()
16 clipper::Grid_sampling mygrid( spgr, cell, reso ); // define grid in c1()
17 clipper::Xmap<float> mymap( spgr, cell, mygrid ); // define map in c1()
30 clipper::Spacegroup spgr = mtzin.spacegroup(); in c2() local
34 clipper::HKL_data<clipper::data32::F_phi> fphidata( spgr, cell, samp ); in c2()
38 clipper::Grid_sampling mygrid( spgr, cell, reso ); // define grid in c2()
39 clipper::Xmap<float> mymap( spgr, cell, mygrid ); // define map in c2()
56 clipper::Spacegroup spgr = fphidata.spacegroup(); in c3() local
60 clipper::Grid_sampling mygrid( spgr, cell, reso ); // define grid in c3()
[all …]
H A Dccad.cpp84 CSpacegroup spgr( "spgr" ); in main() local
85 CCell cell( spgr, "cell" ); in main()
108 spgr.init( Spacegroup( Spgr_descr( tokens[1] ) ) ); in main()
127 if ( spgr.is_null() ) spgr.init( mtzfile.spacegroup() ); in main()
H A Dftndemo_lib.cpp14 clipper::Spacegroup spgr = clipper::Spacegroup( clipper::Spgr_descr( *fspgr ) ); in sfcalc_() local
21 std::cout << " Spacegroup " << spgr.symbol_hall() << " \t " << spgr.symbol_hm() << "\n"; in sfcalc_()
38 clipper::HKL_info hkls( spgr, cell, reso, true ); in sfcalc_()
H A Dtest.new21 /spgr
22 /spgr/cell
23 /spgr/cell/hkl
24 /spgr/cell/hkl/myfphi
25 /spgr/cell/hkl/myfphi2
26 /spgr/cell/hkl/myfsig
27 /spgr/cell2
760 /spgr
761 /spgr/cell
762 /spgr/cell/hkl
[all …]
H A Dsftest.cpp53 clipper::CSpacegroup spgr( "base spgr" ); in main() local
54 clipper::CCell cell( spgr, "base cell" ); in main()
72 spgr.init( mmdb.spacegroup() ); in main()
77 mmdb2.set_spacegroup( spgr ); mmdb2.set_cell( cell ); in main()
97 spgr.clipper::Container::debug(); in main()
98 spgr.clipper::Spacegroup::debug(); in main()
163 clipper::Grid_sampling gsam( spgr, cell, reso, 2.0 ); in main()
166 clipper::Xmap<float> exmap( spgr, cell, gsam ); in main()
H A Dcns2mtz.cpp65 clipper::Spacegroup spgr; in main() local
70 spgr = mmdb.spacegroup(); in main()
79 spgr = clipper::Spacegroup( spgrd ); in main()
236 for ( int s = 0; s < spgr.num_primops(); s++ ) { in main()
237 asu = hkl.transform( spgr.symop(s) ); in main()
238 if ( spgr.recip_asu( asu ) ) break; in main()
240 if ( spgr.recip_asu( asu ) ) break; in main()
254 clipper::HKL_info hkls( spgr, cell, reso ); in main()
/dports/science/clipper/clipper-2.1/clipper/cctbx/
H A Dclipper_cctbx.cpp70 cctbx::sgtbx::space_group CCTBX::spacegroup( const Spacegroup& spgr ) in spacegroup() argument
73 int nsym = spgr.num_symops(); in spacegroup()
75 cspgr.expand_smx( cctbx::sgtbx::rt_mx( spgr.symop(sym).format() ) ); in spacegroup()
80 Spacegroup CCTBX::spacegroup( const cctbx::sgtbx::space_group& spgr ) in spacegroup() argument
83 int nsym = spgr.order_z(); in spacegroup()
85 ops += spgr(sym).as_xyz() + ";"; in spacegroup()
/dports/science/clipper/clipper-2.1/clipper/contrib/
H A Dsfcalc.cpp55 const Spacegroup& spgr = hkls.spacegroup(); in operator ()() local
63 for ( int j = 0; j < spgr.num_symops(); j++ ) { in operator ()()
82 const Spacegroup& spgr = hkls.spacegroup(); in operator ()() local
88 for ( int j = 0; j < spgr.num_symops(); j++ ) { in operator ()()
90 atom.transform( spgr.symop(j).rtop_orth( cell ) ); in operator ()()
109 const Spacegroup& spgr = hkls.spacegroup(); in operator ()() local
110 const Grid_sampling grid( spgr, cell, hkls.resolution(), rate_ ); in operator ()()
111 Xmap<ftype32> xmap( spgr, cell, grid ); in operator ()()
150 const Spacegroup& spgr = hkls.spacegroup(); in operator ()() local
151 const Grid_sampling grid( spgr, cell, hkls.resolution(), rate_ ); in operator ()()
[all …]
H A Dsfcalc_obs.cpp69 const Spacegroup& spgr = hkls.spacegroup(); in operator ()() local
73 const Grid_sampling grid( spgr, cell, hkls.resolution() ); in operator ()()
74 Xmap<float> xmap( spgr, cell, grid ); in operator ()()
/dports/editors/calligra/calligra-3.2.1/filters/stage/powerpoint/
H A Dglobalobjectcollectors.h65 const MSO::OfficeArtSpgrContainerFileBlock& spgr);
68 const MSO::OfficeArtSpgrContainer& spgr) in collectGlobalObjects() argument
70 foreach(const MSO::OfficeArtSpgrContainerFileBlock& o, spgr.rgfb) { in collectGlobalObjects()
89 const MSO::OfficeArtSpgrContainerFileBlock& spgr) in collectGlobalObjects() argument
91 if (spgr.anon.is<MSO::OfficeArtSpContainer>()) in collectGlobalObjects()
92 collectGlobalObjects(collector, *spgr.anon.get<MSO::OfficeArtSpContainer>()); in collectGlobalObjects()
93 if (spgr.anon.is<MSO::OfficeArtSpgrContainer>()) in collectGlobalObjects()
94 collectGlobalObjects(collector, *spgr.anon.get<MSO::OfficeArtSpgrContainer>()); in collectGlobalObjects()
/dports/science/clipper/clipper-2.1/clipper/core/
H A Dcontainer_types.h88 const Spacegroup& spgr = NullSpacegroup ) :
89 Container( name ), Spacegroup( spgr ) {} in Container()
92 const Spacegroup& spgr = NullSpacegroup ) :
93 Container( parent, name ), Spacegroup( spgr ) {} in Container()
H A Dtest_data.cpp2525 Spacegroup spgr = Spacegroup( Spgr_descr( rnasespgr ) ); in Test_data() local
2530 hklinfo.init( spgr, cell, reso, true ); in Test_data()
/dports/science/clipper/clipper-2.1/clipper/fortran/
H A Df_interface.cpp16 clipper::Spacegroup spgr = clipper::Spacegroup( clipper::Spgr_descr( *fspgr ) ); in SFCALC_F77() local
23 std::cout << " Spacegroup " << spgr.symbol_hall() << " \t " << spgr.symbol_hm() << "\n"; in SFCALC_F77()
40 clipper::HKL_info hkls( spgr, cell, reso, true ); in SFCALC_F77()
/dports/www/groupoffice/groupoffice-6.4.231-php-71/vendor/phpoffice/phpexcel/Classes/PHPExcel/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php42 private $spgr = false; variable in PHPExcel_Shared_Escher_DgContainer_SpgrContainer_SpContainer
141 $this->spgr = $value;
151 return $this->spgr;
/dports/www/thirtybees/thirtybees-1.1.0/vendor/phpoffice/phpexcel/Classes/PHPExcel/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php42 private $spgr = false; variable in PHPExcel_Shared_Escher_DgContainer_SpgrContainer_SpContainer
141 $this->spgr = $value;
151 return $this->spgr;
/dports/finance/prestashop/prestashop/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/dolibarr/dolibarr-14.0.3/htdocs/includes/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/dolibarr13/dolibarr-13.0.5/htdocs/includes/phpoffice/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/moodle310/moodle/lib/phpspreadsheet/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/moodle39/moodle/lib/phpspreadsheet/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/ilias/ILIAS-5.4.25/libs/composer/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/groupoffice/groupoffice-6.4.231-php-71/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/www/moodle311/moodle/lib/phpspreadsheet/vendor/phpoffice/phpspreadsheet/src/PhpSpreadsheet/Shared/Escher/DgContainer/SpgrContainer/
H A DSpContainer.php21 private $spgr = false; variable in PhpOffice\\PhpSpreadsheet\\Shared\\Escher\\DgContainer\\SpgrContainer\\SpContainer
120 $this->spgr = $value;
130 return $this->spgr;
/dports/science/clipper/clipper-2.1/clipper/minimol/
H A Dminimol_utils.cpp68 spgr = mol.spacegroup(); in MAtomNonBond()
79 for ( int s = 0; s < spgr.num_symops(); s++ ) { in MAtomNonBond()
80 cf = spgr.symop(s) * mol[p][m][a].coord_orth().coord_frac(cell); in MAtomNonBond()
146 …f2 = spgr.symop(atoms[i].symmetry()) * mol[atoms[i].polymer()][atoms[i].monomer()][atoms[i].atom()… in operator ()()
/dports/editors/calligra/calligra-3.2.1/filters/sheets/excel/sidewinder/
H A Dobjects.cpp87 const MSO::OfficeArtSpgrContainer* spgr = b.anon.get<MSO::OfficeArtSpgrContainer>(); in applyDrawing() local
88 if(spgr) { in applyDrawing()
89 foreach(const MSO::OfficeArtSpgrContainerFileBlock &b, spgr->rgfb) { in applyDrawing()

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