Lines Matching refs:strcasestr

1016   while(!feof(in) && strcasestr(line, "<break>") == 0)  in read_geo_positions()
1026 if (strcasestr(line, "<grid>")) in read_geo_positions()
1041 else if (strcasestr(line, "<break>")) in read_geo_positions()
1046 else if (strcasestr(line, "<end>")) in read_geo_positions()
1098 if (strcasestr(line, "<end>")) m_igrid++; in read_all_grids_from_all_sections()
1099 if (strcasestr(line, "<grid>")) in read_all_grids_from_all_sections()
1121 if (strcasestr(line, "<atom>")) read_additional_atom_block(in, mp); in read_section()
1122 else if (strcasestr(line, "<energy>")) read_energy_block(in, mp); in read_section()
1123 else if (strcasestr(line, "<rms_grad>")) read_rms_grad_block(in, mp); in read_section()
1124 else if (strcasestr(line, "<max_grad>")) read_max_grad_block(in, mp); in read_section()
1125 else if (strcasestr(line, "<bond>")) read_bond_block(in, mp); in read_section()
1126 else if (strcasestr(line, "<dipole>")) read_dipole_block(in, mp); in read_section()
1127 else if (strcasestr(line, "<vector>")) read_vector_block(in, mp); in read_section()
1128 else if (strcasestr(line, "<triangle>")) read_triangle_block(in, mp); in read_section()
1129 else if (strcasestr(line, "<sphere>")) read_sphere_block(in, mp); in read_section()
1130 else if (strcasestr(line, "<surface>")) read_surface_block(in, mp); in read_section()
1131 else if (strcasestr(line, "<cell>")) read_cell_block(in, mp); in read_section()
1132 else if (strcasestr(line, "<textbox>")) read_textbox_block(in, mp); in read_section()
1133 else if (strcasestr(line, "<grid>")) read_grid_block(in, mp); in read_section()
1134 else if (strcasestr(line, "<vibration>")) read_vibration_block(in, mp); in read_section()
1135 … else if (strcasestr(line, "<editable>")) read_editable_block(in, mp); /*19.02.2013 new block!*/ in read_section()
1136 else if (strcasestr(line, "<sleep>")) read_sleep_block(in); in read_section()
1137 else if (strcasestr(line, "<write>")) read_write_block(in); in read_section()
1138 else if (strcasestr(line, "<end>")) next = 0; in read_section()
1221 if (strcasestr(line, "</atom>")) next = 0; in read_additional_atom_block()
1222 if (strcasestr(line,"name")) in read_additional_atom_block()
1224 mp->name[iatom] = my_read_str_value((char*) strcasestr(line,"name")); in read_additional_atom_block()
1227 if ((char*) strcasestr(line,"mulliken_charge")) in read_additional_atom_block()
1229 mp->charge_m[iatom] = my_read_dble_value((char*) strcasestr(line,"mulliken_charge")); in read_additional_atom_block()
1232 if (strcasestr(line,"loprop_charge")) in read_additional_atom_block()
1234 mp->charge_l[iatom] = my_read_dble_value((char*) strcasestr(line,"loprop_charge")); in read_additional_atom_block()
1237 if (strcasestr(line,"number")) in read_additional_atom_block()
1239 mp->additional_numeration[iatom] = my_read_int_value((char*) strcasestr(line,"number")); in read_additional_atom_block()
1242 if (strcasestr(line,"symmetry")) in read_additional_atom_block()
1244 mp->symmetry[iatom] = my_read_int_value((char*) strcasestr(line,"symmetry")); in read_additional_atom_block()
1248 if (strcasestr(line,"red")) in read_additional_atom_block()
1250 mp->elem[iatom].color[0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_additional_atom_block()
1253 if (strcasestr(line,"green")) in read_additional_atom_block()
1255 mp->elem[iatom].color[1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_additional_atom_block()
1258 if (strcasestr(line,"blue")) in read_additional_atom_block()
1260 mp->elem[iatom].color[2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_additional_atom_block()
1305 …if (my_read_int_value((char*) strcasestr(line,"automatic")) == 0) should_bonding_be_determined = 0; in read_bond_block()
1315 if (strcasestr(line, "</bond>")) next = 0; in read_bond_block()
1520 if (strcasestr(line,"red")) in read_vector_block()
1521 mp->vector_color[nvec-1][0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_vector_block()
1522 if (strcasestr(line,"green")) in read_vector_block()
1523 mp->vector_color[nvec-1][1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_vector_block()
1524 if (strcasestr(line,"blue")) in read_vector_block()
1525 mp->vector_color[nvec-1][2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_vector_block()
1526 if (strcasestr(line,"transparency")) in read_vector_block()
1527 mp->vector_color[nvec-1][3] = my_read_dble_value((char*) strcasestr(line,"transparency")); in read_vector_block()
1528 if (strcasestr(line,"radius")) in read_vector_block()
1529 mp->radius[nvec-1] = my_read_dble_value((char*) strcasestr(line,"radius")); in read_vector_block()
1530 if (strcasestr(line,"sharpness")) in read_vector_block()
1531 mp->sharpness[nvec-1] = my_read_dble_value((char*) strcasestr(line,"sharpness")); in read_vector_block()
1563 if (strcasestr(line,"red")) in read_triangle_block()
1564 mp->triangle_color[ntriang-1][0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_triangle_block()
1565 if (strcasestr(line,"green")) in read_triangle_block()
1566 mp->triangle_color[ntriang-1][1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_triangle_block()
1567 if (strcasestr(line,"blue")) in read_triangle_block()
1568 mp->triangle_color[ntriang-1][2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_triangle_block()
1569 if (strcasestr(line,"transparency")) in read_triangle_block()
1570 mp->triangle_color[ntriang-1][3] = my_read_dble_value((char*) strcasestr(line,"transparency")); in read_triangle_block()
1603 if (strcasestr(line,"red")) in read_sphere_block()
1604 mp->sphere_color[nspheres-1][0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_sphere_block()
1605 if (strcasestr(line,"green")) in read_sphere_block()
1606 mp->sphere_color[nspheres-1][1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_sphere_block()
1607 if (strcasestr(line,"blue")) in read_sphere_block()
1608 mp->sphere_color[nspheres-1][2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_sphere_block()
1609 if (strcasestr(line,"transparency")) in read_sphere_block()
1610 mp->sphere_color[nspheres-1][3] = my_read_dble_value((char*) strcasestr(line,"transparency")); in read_sphere_block()
1611 if (strcasestr(line,"radius")) in read_sphere_block()
1612 mp->sphere_radius[nspheres-1] = my_read_dble_value((char*) strcasestr(line,"radius")); in read_sphere_block()
1639 if (strcasestr(line,"red")) in read_surface_block()
1640 mp->surf_color[nsurf-1][0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_surface_block()
1641 if (strcasestr(line,"green")) in read_surface_block()
1642 mp->surf_color[nsurf-1][1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_surface_block()
1643 if (strcasestr(line,"blue")) in read_surface_block()
1644 mp->surf_color[nsurf-1][2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_surface_block()
1645 if (strcasestr(line,"transparency")) in read_surface_block()
1646 mp->surf_color[nsurf-1][3] = my_read_dble_value((char*) strcasestr(line,"transparency")); in read_surface_block()
1685 if (strcasestr(line,"red")) in read_cell_block()
1686 mp->cell_color[ncell-1][0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_cell_block()
1687 if (strcasestr(line,"green")) in read_cell_block()
1688 mp->cell_color[ncell-1][1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_cell_block()
1689 if (strcasestr(line,"blue")) in read_cell_block()
1690 mp->cell_color[ncell-1][2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_cell_block()
1691 if (strcasestr(line,"transparency")) in read_cell_block()
1692 mp->cell_color[ncell-1][3] = my_read_dble_value((char*) strcasestr(line,"transparency")); in read_cell_block()
1732 if (strcasestr(line,"red")) in read_textbox_block()
1733 mp->textboxes[itb].color[0] = my_read_dble_value((char*) strcasestr(line,"red")); in read_textbox_block()
1734 if (strcasestr(line,"green")) in read_textbox_block()
1735 mp->textboxes[itb].color[1] = my_read_dble_value((char*) strcasestr(line,"green")); in read_textbox_block()
1736 if (strcasestr(line,"blue")) in read_textbox_block()
1737 mp->textboxes[itb].color[2] = my_read_dble_value((char*) strcasestr(line,"blue")); in read_textbox_block()
1738 if (strcasestr(line,"x")) in read_textbox_block()
1739 mp->textboxes[itb].coord_x = my_read_int_value((char*) strcasestr(line,"x")); in read_textbox_block()
1740 if (strcasestr(line,"y")) in read_textbox_block()
1741 mp->textboxes[itb].coord_y = my_read_int_value((char*) strcasestr(line,"y")); in read_textbox_block()
1798 if (strcasestr(line,"N_OF_MO")) in read_grid_block()
1799 mp->grid.nmo = my_read_int_value((char*) strcasestr(line,"N_OF_MO")); in read_grid_block()
1800 if (strcasestr(line,"N_of_Grids")) in read_grid_block()
1801 mp->ngrids = mp->grid.ngrid = my_read_int_value((char*) strcasestr(line,"N_of_Grids")); in read_grid_block()
1802 if (strcasestr(line,"N_of_Points")) in read_grid_block()
1803 mp->grid.npoints = my_read_int_value((char*) strcasestr(line,"N_of_Points")); in read_grid_block()
1804 if (strcasestr(line,"Block_Size")) in read_grid_block()
1805 mp->grid.block_size = my_read_int_value((char*) strcasestr(line,"Block_Size")); in read_grid_block()
1806 if (strcasestr(line,"N_Blocks")) in read_grid_block()
1807 mp->grid.nBlock = my_read_int_value((char*) strcasestr(line,"N_Blocks")); in read_grid_block()
1808 if (strcasestr(line,"Is_cutoff")) in read_grid_block()
1809 mp->grid.isCutOff = my_read_int_value((char*) strcasestr(line,"Is_cutoff")); in read_grid_block()
1810 if (strcasestr(line,"CutOff")) in read_grid_block()
1811 mp->grid.CutOff = my_read_dble_value((char*) strcasestr(line,"CutOff")); in read_grid_block()
1812 if (strcasestr(line,"N_P")) in read_grid_block()
1813 mp->grid.nPointsCutOff = my_read_int_value((char*) strcasestr(line,"N_P")); in read_grid_block()
1814 if (strcasestr(line,"BOHR")) myR529 = R529; in read_grid_block()
2019 if (strcasestr(line,"GridName")) in read_grid_block()
2021 mp->grid.titlesArr[i] = my_read_str_value((char*) strcasestr(line,"GridName")); in read_grid_block()
2022 if (strcasestr(line, "Orbital")) in read_grid_block()
2025 if (strcasestr(line, "sym")) in read_grid_block()
2026 mp->grid_symmetry[i] = my_read_int_value((char*) strcasestr(line,"sym")); in read_grid_block()
2030 if (strcasestr(line, "index")) in read_grid_block()
2031 mp->grid_index[i] = my_read_int_value((char*) strcasestr(line,"index")); in read_grid_block()
2035 if (strcasestr(line, "Energ")) in read_grid_block()
2036 mp->grid_energy[i] = my_read_dble_value((char*) strcasestr(line,"energ")); in read_grid_block()
2040 if (strcasestr(line, "OCc")) in read_grid_block()
2041 mp->grid_occ[i] = my_read_dble_value((char*) strcasestr(line,"occ")); in read_grid_block()
2045 if (strcasestr(line, "type")) in read_grid_block()
2047 for(ptr = (char*) strcasestr(line, "type"); ptr[0] != '='; ptr++); in read_grid_block()
2065 else if (strcasestr(line, "Electrostatic")) in read_grid_block()
2103 if (strcasestr(line, "density")) next = 0; in read_grid_block()
2104 if (strcasestr(line, "/grid") || feof(in)) in read_grid_block()
2158 if (strcasestr(line, "/grid")) next = 0; in read_grid_block()
2284 if (strcasestr(line,"freq")) in read_vibration_block()
2285 mp->freq[nvibs-1] = my_read_dble_value((char*) strcasestr(line,"freq")); in read_vibration_block()
2286 if (strcasestr(line,"ir_int")) in read_vibration_block()
2288 mp->ir_intensity[nvibs-1] = my_read_dble_value((char*) strcasestr(line,"ir_int")); in read_vibration_block()
2291 if (strcasestr(line,"raman_int")) in read_vibration_block()
2293 mp->raman_intensity[nvibs-1] = my_read_dble_value((char*) strcasestr(line,"raman_int")); in read_vibration_block()
2311 if (strcasestr(line,"yes")) mp->editable=1; in read_editable_block()
2312 else if (strcasestr(line,"no")) mp->editable=0; in read_editable_block()
2340 } while(!strcasestr(line,"write") && feof(in)); in read_write_block()