| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/io/ |
| H A D | vaspformat.cpp | 254 const Matrix3& mat = mol.unitCell()->cellMatrix().transpose(); in write()
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| H A D | gromacsformat.cpp | 220 Matrix3 cellMatrix = Matrix3::Zero(); in read() local
222 cellMatrix(rows[i], cols[i]) = lexicalCast<Real>(tokens[i], ok); in read()
231 cell->setCellMatrix(cellMatrix * static_cast<Real>(10)); // nm --> Angstrom in read()
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| H A D | lammpsformat.cpp | 552 const Matrix3& mat = unitcell->cellMatrix().transpose(); in write()
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| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/qtgui/ |
| H A D | rwmolecule.h | 507 void editUnitCell(Matrix3 cellMatrix, Core::CrystalTools::Options opts);
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| H A D | rwmolecule.cpp | 1074 void RWMolecule::editUnitCell(Matrix3 cellMatrix, CrystalTools::Options options) in editUnitCell() argument
1084 CrystalTools::setCellMatrix(newMolecule, cellMatrix, options); in editUnitCell()
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| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/qtplugins/yaehmop/ |
| H A D | yaehmop.cpp | 444 const Matrix3& cellMatrix = cell->cellMatrix(); in createGeometryAndLatticeInput() local
459 double val = cellMatrix(i - 1, j); in createGeometryAndLatticeInput()
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/core/ |
| H A D | crystaltools.cpp | 57 const Matrix3& before = cell.cellMatrix(); in rotateToStandardOrientation()
138 const Matrix3 newMatrix(cell.cellMatrix() * scaleFactor); in setVolume()
451 cell.setCellMatrix(cell.cellMatrix() * cob); in niggliReduce()
457 cell.setCellMatrix(cell.cellMatrix() * cob); in niggliReduce()
615 molecule.unitCell()->cellMatrix().inverse()); in setCellMatrix()
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| H A D | unitcell.h | 38 explicit UnitCell(const Matrix3& cellMatrix);
90 const Matrix3& cellMatrix() const;
255 inline const Matrix3& UnitCell::cellMatrix() const in cellMatrix() function
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| H A D | avospglib.cpp | 40 Matrix3 cellMat = uc->cellMatrix(); in getHallNumber()
109 Matrix3 cellMat = uc->cellMatrix(); in standardizeCell()
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/io/ |
| H A D | gromacsformat.cpp | 220 Matrix3 cellMatrix = Matrix3::Zero(); in read() local
222 cellMatrix(rows[i], cols[i]) = lexicalCast<Real>(tokens[i], ok); in read()
231 cell->setCellMatrix(cellMatrix * static_cast<Real>(10)); // nm --> Angstrom in read()
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| H A D | vaspformat.cpp | 254 const Matrix3& mat = mol.unitCell()->cellMatrix().transpose(); in write()
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| H A D | lammpsformat.cpp | 552 const Matrix3& mat = unitcell->cellMatrix().transpose(); in write()
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/qtgui/ |
| H A D | rwmolecule.cpp | 1074 void RWMolecule::editUnitCell(Matrix3 cellMatrix, CrystalTools::Options options) in editUnitCell() argument
1084 CrystalTools::setCellMatrix(newMolecule, cellMatrix, options); in editUnitCell()
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| H A D | rwmolecule.h | 507 void editUnitCell(Matrix3 cellMatrix, Core::CrystalTools::Options opts);
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/qtplugins/yaehmop/ |
| H A D | yaehmop.cpp | 444 const Matrix3& cellMatrix = cell->cellMatrix(); in createGeometryAndLatticeInput() local
459 double val = cellMatrix(i - 1, j); in createGeometryAndLatticeInput()
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/qtplugins/crystal/ |
| H A D | unitcelldialog.cpp | 60 connect(m_ui->cellMatrix, SIGNAL(textChanged()), SLOT(cellMatrixEdited())); in UnitCellDialog()
145 m_molecule->undoMolecule()->editUnitCell(m_tempCell.cellMatrix(), in apply()
195 m_ui->cellMatrix->setEnabled(e); in enableCellMatrix()
225 m_ui->cellMatrix->blockSignals(e); in blockCellMatrixSignals()
259 m_ui->cellMatrix->setPlainText(matrixToString(m_tempCell.cellMatrix())); in revertCellMatrix()
262 m_ui->cellMatrix->setPlainText(tr("No unit cell present.")); in revertCellMatrix()
292 m_tempCell.setCellMatrix(stringToMatrix(m_ui->cellMatrix->toPlainText())); in updateCellMatrix()
303 return validateMatrixEditor(m_ui->cellMatrix); in validateCellMatrix()
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| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/core/ |
| H A D | crystaltools.cpp | 57 const Matrix3& before = cell.cellMatrix(); in rotateToStandardOrientation()
138 const Matrix3 newMatrix(cell.cellMatrix() * scaleFactor); in setVolume()
451 cell.setCellMatrix(cell.cellMatrix() * cob); in niggliReduce()
457 cell.setCellMatrix(cell.cellMatrix() * cob); in niggliReduce()
615 molecule.unitCell()->cellMatrix().inverse()); in setCellMatrix()
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| H A D | unitcell.h | 38 explicit UnitCell(const Matrix3& cellMatrix);
90 const Matrix3& cellMatrix() const;
255 inline const Matrix3& UnitCell::cellMatrix() const in cellMatrix() function
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| H A D | avospglib.cpp | 40 Matrix3 cellMat = uc->cellMatrix(); in getHallNumber()
109 Matrix3 cellMat = uc->cellMatrix(); in standardizeCell()
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| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/qtplugins/crystal/ |
| H A D | unitcelldialog.cpp | 60 connect(m_ui->cellMatrix, SIGNAL(textChanged()), SLOT(cellMatrixEdited())); in UnitCellDialog()
145 m_molecule->undoMolecule()->editUnitCell(m_tempCell.cellMatrix(), in apply()
195 m_ui->cellMatrix->setEnabled(e); in enableCellMatrix()
225 m_ui->cellMatrix->blockSignals(e); in blockCellMatrixSignals()
259 m_ui->cellMatrix->setPlainText(matrixToString(m_tempCell.cellMatrix())); in revertCellMatrix()
262 m_ui->cellMatrix->setPlainText(tr("No unit cell present.")); in revertCellMatrix()
292 m_tempCell.setCellMatrix(stringToMatrix(m_ui->cellMatrix->toPlainText())); in updateCellMatrix()
303 return validateMatrixEditor(m_ui->cellMatrix); in validateCellMatrix()
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| /dports/www/tikiwiki/tiki-21.2/vendor_bundled/vendor/fullcalendar/fullcalendar/src/basic/ |
| H A D | DayGrid.ts | 495 let cellMatrix // a matrix (by level, then column) of all <td> jQuery elements in the row
515 td = cellMatrix[levelLimit - 1][col]
527 cellMatrix = rowStruct.cellMatrix
548 td = cellMatrix[levelLimit - 1][seg.leftCol] // the segment's parent cell
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| H A D | DayGridEventRenderer.ts | 87 let cellMatrix = [] // lookup for all <td> elements of the level+col matrix
111 cellMatrix[i][col] = td
123 cellMatrix.push([])
143 cellMatrix[i][col] = td
160 cellMatrix: cellMatrix,
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| /dports/www/tikiwiki/tiki-21.2/vendor_bundled/vendor/fullcalendar/fullcalendar/dist/ |
| H A D | fullcalendar.d.ts | 2241 cellMatrix: any[];
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| /dports/science/openbabel/openbabel-3.1.1/src/formats/ |
| H A D | siestaformat.cpp | 103 matrix3x3 cellMatrix; in ReadMolecule() local
162 cellMatrix(i,j) = atof(vs.at(j).c_str()); in ReadMolecule()
167 cell->SetData(cellMatrix); in ReadMolecule()
372 cellMatrix(i,j) = atof(vs.at(j).c_str()); in ReadMolecule()
377 cell->SetData(cellMatrix); in ReadMolecule()
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| /dports/science/libgeodecomp/libgeodecomp-0.4.0/src/storage/test/unit/ |
| H A D | gridtest.h | 131 other.cellMatrix[y][x] = testGrid->cellMatrix[y][x]; in testOperatorEqual1()
|