BALL: MMFF94ConfigurationDialogData.h Source File

00001 /********************************************************************************
00002 ** Form generated from reading ui file 'MMFF94ConfigurationDialog.ui'
00003 **
00004 ** Created: Thu Aug 6 17:05:52 2009
00005 **      by: Qt User Interface Compiler version 4.4.0
00006 **
00007 ** WARNING! All changes made in this file will be lost when recompiling ui file!
00008 ********************************************************************************/
00009 
00010 #ifndef MMFF94CONFIGURATIONDIALOGDATA_H
00011 #define MMFF94CONFIGURATIONDIALOGDATA_H
00012 
00013 #include <BALL/COMMON/global.h>
00014 #include <QtCore/QVariant>
00015 #include <QtGui/QAction>
00016 #include <QtGui/QApplication>
00017 #include <QtGui/QButtonGroup>
00018 #include <QtGui/QCheckBox>
00019 #include <QtGui/QDialog>
00020 #include <QtGui/QGridLayout>
00021 #include <QtGui/QGroupBox>
00022 #include <QtGui/QHBoxLayout>
00023 #include <QtGui/QLabel>
00024 #include <QtGui/QLineEdit>
00025 #include <QtGui/QPushButton>
00026 #include <QtGui/QRadioButton>
00027 #include <QtGui/QVBoxLayout>
00028 
00029 QT_BEGIN_NAMESPACE
00030 
00031 class Ui_MMFF94ConfigurationDialogData
00032 {
00033 public:
00034     QGridLayout *gridLayout;
00035     QHBoxLayout *hboxLayout;
00036     QPushButton *close_button;
00037     QPushButton *cancel_button;
00038     QPushButton *reset_button;
00039     QGroupBox *cutoff_options;
00040     QGridLayout *gridLayout1;
00041     QLineEdit *nonbonded_cutoff;
00042     QLineEdit *vdw_cutoff;
00043     QLineEdit *electrostatic_cutoff;
00044     QLabel *nonbonded_cutoff_label_2;
00045     QLabel *nonbonded_cutoff_label_2_2_3;
00046     QLabel *nonbonded_cutoff_label_2_2_3_2;
00047     QLineEdit *vdw_cuton;
00048     QLineEdit *electrostatic_cuton;
00049     QLabel *nonbonded_cutoff_label_2_2;
00050     QLabel *nonbonded_cutoff_label_2_2_2;
00051     QLabel *nonbonded_cutoff_label;
00052     QLabel *vdw_cutoff_label;
00053     QLabel *electrostatic_cutoff_label;
00054     QGroupBox *dielectric_group;
00055     QHBoxLayout *hboxLayout1;
00056     QRadioButton *constant_button;
00057     QRadioButton *distance_button;
00058     QGroupBox *groupBox11;
00059     QHBoxLayout *hboxLayout2;
00060     QLabel *textLabel1;
00061     QLineEdit *max_unassigned_atoms;
00062     QGroupBox *groupBox12;
00063     QHBoxLayout *hboxLayout3;
00064     QLabel *Label_10;
00065     QLineEdit *parameter_file_edit;
00066     QPushButton *browse_button;
00067     QGroupBox *groupBox;
00068     QVBoxLayout *vboxLayout;
00069     QCheckBox *stretch_box;
00070     QCheckBox *bends_box;
00071     QCheckBox *stretch_bends_box;
00072     QCheckBox *torsions_box;
00073     QCheckBox *plane_box;
00074     QCheckBox *vdw_box;
00075     QCheckBox *es_box;
00076     QGroupBox *check_options;
00077     QVBoxLayout *vboxLayout1;
00078     QCheckBox *assign_charges_checkBox;
00079     QCheckBox *assign_typenames_checkBox;
00080     QCheckBox *assign_types_checkBox;
00081     QCheckBox *overwrite_charges_checkBox;
00082     QCheckBox *overwrite_typenames_checkBox;
00083 
00084     void setupUi(QDialog *MMFF94ConfigurationDialogData)
00085     {
00086     if (MMFF94ConfigurationDialogData->objectName().isEmpty())
00087         MMFF94ConfigurationDialogData->setObjectName(QString::fromUtf8("MMFF94ConfigurationDialogData"));
00088     MMFF94ConfigurationDialogData->resize(530, 584);
00089     QSizePolicy sizePolicy(static_cast<QSizePolicy::Policy>(5), static_cast<QSizePolicy::Policy>(5));
00090     sizePolicy.setHorizontalStretch(0);
00091     sizePolicy.setVerticalStretch(0);
00092     sizePolicy.setHeightForWidth(MMFF94ConfigurationDialogData->sizePolicy().hasHeightForWidth());
00093     MMFF94ConfigurationDialogData->setSizePolicy(sizePolicy);
00094     MMFF94ConfigurationDialogData->setMinimumSize(QSize(0, 0));
00095     MMFF94ConfigurationDialogData->setMaximumSize(QSize(6500, 4900));
00096     gridLayout = new QGridLayout(MMFF94ConfigurationDialogData);
00097     gridLayout->setSpacing(6);
00098     gridLayout->setMargin(5);
00099     gridLayout->setObjectName(QString::fromUtf8("gridLayout"));
00100     hboxLayout = new QHBoxLayout();
00101     hboxLayout->setSpacing(6);
00102     hboxLayout->setMargin(0);
00103     hboxLayout->setObjectName(QString::fromUtf8("hboxLayout"));
00104     close_button = new QPushButton(MMFF94ConfigurationDialogData);
00105     close_button->setObjectName(QString::fromUtf8("close_button"));
00106     QSizePolicy sizePolicy1(static_cast<QSizePolicy::Policy>(3), static_cast<QSizePolicy::Policy>(0));
00107     sizePolicy1.setHorizontalStretch(0);
00108     sizePolicy1.setVerticalStretch(0);
00109     sizePolicy1.setHeightForWidth(close_button->sizePolicy().hasHeightForWidth());
00110     close_button->setSizePolicy(sizePolicy1);
00111     close_button->setMinimumSize(QSize(0, 30));
00112     close_button->setDefault(true);
00113 
00114     hboxLayout->addWidget(close_button);
00115 
00116     cancel_button = new QPushButton(MMFF94ConfigurationDialogData);
00117     cancel_button->setObjectName(QString::fromUtf8("cancel_button"));
00118     sizePolicy1.setHeightForWidth(cancel_button->sizePolicy().hasHeightForWidth());
00119     cancel_button->setSizePolicy(sizePolicy1);
00120     cancel_button->setMinimumSize(QSize(0, 30));
00121 
00122     hboxLayout->addWidget(cancel_button);
00123 
00124     reset_button = new QPushButton(MMFF94ConfigurationDialogData);
00125     reset_button->setObjectName(QString::fromUtf8("reset_button"));
00126     sizePolicy1.setHeightForWidth(reset_button->sizePolicy().hasHeightForWidth());
00127     reset_button->setSizePolicy(sizePolicy1);
00128     reset_button->setMinimumSize(QSize(0, 30));
00129 
00130     hboxLayout->addWidget(reset_button);
00131 
00132 
00133     gridLayout->addLayout(hboxLayout, 5, 0, 1, 2);
00134 
00135     cutoff_options = new QGroupBox(MMFF94ConfigurationDialogData);
00136     cutoff_options->setObjectName(QString::fromUtf8("cutoff_options"));
00137     cutoff_options->setMinimumSize(QSize(520, 0));
00138     cutoff_options->setAlignment(Qt::AlignHCenter);
00139     gridLayout1 = new QGridLayout(cutoff_options);
00140     gridLayout1->setSpacing(6);
00141     gridLayout1->setMargin(5);
00142     gridLayout1->setObjectName(QString::fromUtf8("gridLayout1"));
00143     nonbonded_cutoff = new QLineEdit(cutoff_options);
00144     nonbonded_cutoff->setObjectName(QString::fromUtf8("nonbonded_cutoff"));
00145     QSizePolicy sizePolicy2(static_cast<QSizePolicy::Policy>(7), static_cast<QSizePolicy::Policy>(0));
00146     sizePolicy2.setHorizontalStretch(0);
00147     sizePolicy2.setVerticalStretch(0);
00148     sizePolicy2.setHeightForWidth(nonbonded_cutoff->sizePolicy().hasHeightForWidth());
00149     nonbonded_cutoff->setSizePolicy(sizePolicy2);
00150     nonbonded_cutoff->setMinimumSize(QSize(0, 25));
00151     nonbonded_cutoff->setMaxLength(32767);
00152     nonbonded_cutoff->setFrame(true);
00153     nonbonded_cutoff->setEchoMode(QLineEdit::Normal);
00154     nonbonded_cutoff->setAlignment(Qt::AlignRight);
00155 
00156     gridLayout1->addWidget(nonbonded_cutoff, 0, 1, 1, 1);
00157 
00158     vdw_cutoff = new QLineEdit(cutoff_options);
00159     vdw_cutoff->setObjectName(QString::fromUtf8("vdw_cutoff"));
00160     vdw_cutoff->setEnabled(true);
00161     sizePolicy2.setHeightForWidth(vdw_cutoff->sizePolicy().hasHeightForWidth());
00162     vdw_cutoff->setSizePolicy(sizePolicy2);
00163     vdw_cutoff->setMinimumSize(QSize(0, 25));
00164     vdw_cutoff->setFrame(true);
00165     vdw_cutoff->setEchoMode(QLineEdit::Normal);
00166     vdw_cutoff->setAlignment(Qt::AlignRight);
00167 
00168     gridLayout1->addWidget(vdw_cutoff, 1, 1, 1, 1);
00169 
00170     electrostatic_cutoff = new QLineEdit(cutoff_options);
00171     electrostatic_cutoff->setObjectName(QString::fromUtf8("electrostatic_cutoff"));
00172     electrostatic_cutoff->setEnabled(true);
00173     electrostatic_cutoff->setMinimumSize(QSize(0, 25));
00174     electrostatic_cutoff->setAlignment(Qt::AlignRight);
00175 
00176     gridLayout1->addWidget(electrostatic_cutoff, 2, 1, 1, 1);
00177 
00178     nonbonded_cutoff_label_2 = new QLabel(cutoff_options);
00179     nonbonded_cutoff_label_2->setObjectName(QString::fromUtf8("nonbonded_cutoff_label_2"));
00180     sizePolicy.setHeightForWidth(nonbonded_cutoff_label_2->sizePolicy().hasHeightForWidth());
00181     nonbonded_cutoff_label_2->setSizePolicy(sizePolicy);
00182     nonbonded_cutoff_label_2->setMinimumSize(QSize(25, 0));
00183     nonbonded_cutoff_label_2->setMaximumSize(QSize(30, 32767));
00184 
00185     gridLayout1->addWidget(nonbonded_cutoff_label_2, 0, 2, 1, 1);
00186 
00187     nonbonded_cutoff_label_2_2_3 = new QLabel(cutoff_options);
00188     nonbonded_cutoff_label_2_2_3->setObjectName(QString::fromUtf8("nonbonded_cutoff_label_2_2_3"));
00189     sizePolicy.setHeightForWidth(nonbonded_cutoff_label_2_2_3->sizePolicy().hasHeightForWidth());
00190     nonbonded_cutoff_label_2_2_3->setSizePolicy(sizePolicy);
00191     nonbonded_cutoff_label_2_2_3->setMinimumSize(QSize(25, 0));
00192     nonbonded_cutoff_label_2_2_3->setMaximumSize(QSize(30, 32767));
00193 
00194     gridLayout1->addWidget(nonbonded_cutoff_label_2_2_3, 1, 2, 1, 1);
00195 
00196     nonbonded_cutoff_label_2_2_3_2 = new QLabel(cutoff_options);
00197     nonbonded_cutoff_label_2_2_3_2->setObjectName(QString::fromUtf8("nonbonded_cutoff_label_2_2_3_2"));
00198     sizePolicy.setHeightForWidth(nonbonded_cutoff_label_2_2_3_2->sizePolicy().hasHeightForWidth());
00199     nonbonded_cutoff_label_2_2_3_2->setSizePolicy(sizePolicy);
00200     nonbonded_cutoff_label_2_2_3_2->setMinimumSize(QSize(25, 0));
00201     nonbonded_cutoff_label_2_2_3_2->setMaximumSize(QSize(30, 32767));
00202 
00203     gridLayout1->addWidget(nonbonded_cutoff_label_2_2_3_2, 2, 2, 1, 1);
00204 
00205     vdw_cuton = new QLineEdit(cutoff_options);
00206     vdw_cuton->setObjectName(QString::fromUtf8("vdw_cuton"));
00207     vdw_cuton->setEnabled(true);
00208     vdw_cuton->setAlignment(Qt::AlignRight);
00209 
00210     gridLayout1->addWidget(vdw_cuton, 1, 3, 1, 1);
00211 
00212     electrostatic_cuton = new QLineEdit(cutoff_options);
00213     electrostatic_cuton->setObjectName(QString::fromUtf8("electrostatic_cuton"));
00214     electrostatic_cuton->setEnabled(true);
00215     electrostatic_cuton->setAlignment(Qt::AlignRight);
00216 
00217     gridLayout1->addWidget(electrostatic_cuton, 2, 3, 1, 1);
00218 
00219     nonbonded_cutoff_label_2_2 = new QLabel(cutoff_options);
00220     nonbonded_cutoff_label_2_2->setObjectName(QString::fromUtf8("nonbonded_cutoff_label_2_2"));
00221     sizePolicy.setHeightForWidth(nonbonded_cutoff_label_2_2->sizePolicy().hasHeightForWidth());
00222     nonbonded_cutoff_label_2_2->setSizePolicy(sizePolicy);
00223     nonbonded_cutoff_label_2_2->setMinimumSize(QSize(15, 0));
00224     nonbonded_cutoff_label_2_2->setMaximumSize(QSize(30, 32767));
00225 
00226     gridLayout1->addWidget(nonbonded_cutoff_label_2_2, 1, 4, 1, 1);
00227 
00228     nonbonded_cutoff_label_2_2_2 = new QLabel(cutoff_options);
00229     nonbonded_cutoff_label_2_2_2->setObjectName(QString::fromUtf8("nonbonded_cutoff_label_2_2_2"));
00230     sizePolicy.setHeightForWidth(nonbonded_cutoff_label_2_2_2->sizePolicy().hasHeightForWidth());
00231     nonbonded_cutoff_label_2_2_2->setSizePolicy(sizePolicy);
00232     nonbonded_cutoff_label_2_2_2->setMinimumSize(QSize(15, 0));
00233     nonbonded_cutoff_label_2_2_2->setMaximumSize(QSize(30, 32767));
00234 
00235     gridLayout1->addWidget(nonbonded_cutoff_label_2_2_2, 2, 4, 1, 1);
00236 
00237     nonbonded_cutoff_label = new QLabel(cutoff_options);
00238     nonbonded_cutoff_label->setObjectName(QString::fromUtf8("nonbonded_cutoff_label"));
00239     QSizePolicy sizePolicy3(static_cast<QSizePolicy::Policy>(7), static_cast<QSizePolicy::Policy>(5));
00240     sizePolicy3.setHorizontalStretch(0);
00241     sizePolicy3.setVerticalStretch(0);
00242     sizePolicy3.setHeightForWidth(nonbonded_cutoff_label->sizePolicy().hasHeightForWidth());
00243     nonbonded_cutoff_label->setSizePolicy(sizePolicy3);
00244     nonbonded_cutoff_label->setMinimumSize(QSize(260, 25));
00245 
00246     gridLayout1->addWidget(nonbonded_cutoff_label, 0, 0, 1, 1);
00247 
00248     vdw_cutoff_label = new QLabel(cutoff_options);
00249     vdw_cutoff_label->setObjectName(QString::fromUtf8("vdw_cutoff_label"));
00250     sizePolicy3.setHeightForWidth(vdw_cutoff_label->sizePolicy().hasHeightForWidth());
00251     vdw_cutoff_label->setSizePolicy(sizePolicy3);
00252     vdw_cutoff_label->setMinimumSize(QSize(260, 25));
00253 
00254     gridLayout1->addWidget(vdw_cutoff_label, 1, 0, 1, 1);
00255 
00256     electrostatic_cutoff_label = new QLabel(cutoff_options);
00257     electrostatic_cutoff_label->setObjectName(QString::fromUtf8("electrostatic_cutoff_label"));
00258     sizePolicy3.setHeightForWidth(electrostatic_cutoff_label->sizePolicy().hasHeightForWidth());
00259     electrostatic_cutoff_label->setSizePolicy(sizePolicy3);
00260     electrostatic_cutoff_label->setMinimumSize(QSize(260, 25));
00261 
00262     gridLayout1->addWidget(electrostatic_cutoff_label, 2, 0, 1, 1);
00263 
00264 
00265     gridLayout->addWidget(cutoff_options, 4, 0, 1, 2);
00266 
00267     dielectric_group = new QGroupBox(MMFF94ConfigurationDialogData);
00268     dielectric_group->setObjectName(QString::fromUtf8("dielectric_group"));
00269     QSizePolicy sizePolicy4(static_cast<QSizePolicy::Policy>(1), static_cast<QSizePolicy::Policy>(1));
00270     sizePolicy4.setHorizontalStretch(0);
00271     sizePolicy4.setVerticalStretch(0);
00272     sizePolicy4.setHeightForWidth(dielectric_group->sizePolicy().hasHeightForWidth());
00273     dielectric_group->setSizePolicy(sizePolicy4);
00274     dielectric_group->setMinimumSize(QSize(180, 0));
00275     dielectric_group->setAlignment(Qt::AlignHCenter);
00276     hboxLayout1 = new QHBoxLayout(dielectric_group);
00277     hboxLayout1->setSpacing(6);
00278     hboxLayout1->setMargin(5);
00279     hboxLayout1->setObjectName(QString::fromUtf8("hboxLayout1"));
00280     constant_button = new QRadioButton(dielectric_group);
00281     constant_button->setObjectName(QString::fromUtf8("constant_button"));
00282     QSizePolicy sizePolicy5(static_cast<QSizePolicy::Policy>(7), static_cast<QSizePolicy::Policy>(1));
00283     sizePolicy5.setHorizontalStretch(0);
00284     sizePolicy5.setVerticalStretch(0);
00285     sizePolicy5.setHeightForWidth(constant_button->sizePolicy().hasHeightForWidth());
00286     constant_button->setSizePolicy(sizePolicy5);
00287     constant_button->setMinimumSize(QSize(0, 0));
00288     constant_button->setMaximumSize(QSize(32000, 32767));
00289     constant_button->setChecked(true);
00290 
00291     hboxLayout1->addWidget(constant_button);
00292 
00293     distance_button = new QRadioButton(dielectric_group);
00294     distance_button->setObjectName(QString::fromUtf8("distance_button"));
00295     QSizePolicy sizePolicy6(static_cast<QSizePolicy::Policy>(3), static_cast<QSizePolicy::Policy>(1));
00296     sizePolicy6.setHorizontalStretch(0);
00297     sizePolicy6.setVerticalStretch(0);
00298     sizePolicy6.setHeightForWidth(distance_button->sizePolicy().hasHeightForWidth());
00299     distance_button->setSizePolicy(sizePolicy6);
00300     distance_button->setMinimumSize(QSize(0, 0));
00301 
00302     hboxLayout1->addWidget(distance_button);
00303 
00304 
00305     gridLayout->addWidget(dielectric_group, 3, 0, 1, 2);
00306 
00307     groupBox11 = new QGroupBox(MMFF94ConfigurationDialogData);
00308     groupBox11->setObjectName(QString::fromUtf8("groupBox11"));
00309     groupBox11->setAlignment(Qt::AlignHCenter);
00310     hboxLayout2 = new QHBoxLayout(groupBox11);
00311     hboxLayout2->setSpacing(6);
00312     hboxLayout2->setMargin(5);
00313     hboxLayout2->setObjectName(QString::fromUtf8("hboxLayout2"));
00314     textLabel1 = new QLabel(groupBox11);
00315     textLabel1->setObjectName(QString::fromUtf8("textLabel1"));
00316     sizePolicy5.setHeightForWidth(textLabel1->sizePolicy().hasHeightForWidth());
00317     textLabel1->setSizePolicy(sizePolicy5);
00318     textLabel1->setMinimumSize(QSize(0, 28));
00319     textLabel1->setAlignment(Qt::AlignLeading|Qt::AlignLeft|Qt::AlignVCenter);
00320 
00321     hboxLayout2->addWidget(textLabel1);
00322 
00323     max_unassigned_atoms = new QLineEdit(groupBox11);
00324     max_unassigned_atoms->setObjectName(QString::fromUtf8("max_unassigned_atoms"));
00325     max_unassigned_atoms->setMinimumSize(QSize(100, 25));
00326     max_unassigned_atoms->setMaximumSize(QSize(100, 25));
00327     max_unassigned_atoms->setAlignment(Qt::AlignRight);
00328 
00329     hboxLayout2->addWidget(max_unassigned_atoms);
00330 
00331 
00332     gridLayout->addWidget(groupBox11, 1, 0, 1, 2);
00333 
00334     groupBox12 = new QGroupBox(MMFF94ConfigurationDialogData);
00335     groupBox12->setObjectName(QString::fromUtf8("groupBox12"));
00336     groupBox12->setAlignment(Qt::AlignHCenter);
00337     hboxLayout3 = new QHBoxLayout(groupBox12);
00338     hboxLayout3->setSpacing(6);
00339     hboxLayout3->setMargin(5);
00340     hboxLayout3->setObjectName(QString::fromUtf8("hboxLayout3"));
00341     Label_10 = new QLabel(groupBox12);
00342     Label_10->setObjectName(QString::fromUtf8("Label_10"));
00343     QSizePolicy sizePolicy7(static_cast<QSizePolicy::Policy>(5), static_cast<QSizePolicy::Policy>(1));
00344     sizePolicy7.setHorizontalStretch(0);
00345     sizePolicy7.setVerticalStretch(0);
00346     sizePolicy7.setHeightForWidth(Label_10->sizePolicy().hasHeightForWidth());
00347     Label_10->setSizePolicy(sizePolicy7);
00348     Label_10->setMinimumSize(QSize(0, 25));
00349     Label_10->setFocusPolicy(Qt::NoFocus);
00350     Label_10->setLineWidth(1);
00351     Label_10->setTextFormat(Qt::AutoText);
00352     Label_10->setAlignment(Qt::AlignRight|Qt::AlignTrailing|Qt::AlignVCenter);
00353 
00354     hboxLayout3->addWidget(Label_10);
00355 
00356     parameter_file_edit = new QLineEdit(groupBox12);
00357     parameter_file_edit->setObjectName(QString::fromUtf8("parameter_file_edit"));
00358     parameter_file_edit->setMinimumSize(QSize(150, 25));
00359     parameter_file_edit->setFocusPolicy(Qt::StrongFocus);
00360     parameter_file_edit->setMaxLength(32767);
00361     parameter_file_edit->setFrame(true);
00362     parameter_file_edit->setEchoMode(QLineEdit::Normal);
00363     parameter_file_edit->setAlignment(Qt::AlignLeading);
00364 
00365     hboxLayout3->addWidget(parameter_file_edit);
00366 
00367     browse_button = new QPushButton(groupBox12);
00368     browse_button->setObjectName(QString::fromUtf8("browse_button"));
00369     browse_button->setMinimumSize(QSize(50, 25));
00370     browse_button->setFocusPolicy(Qt::TabFocus);
00371     browse_button->setAutoDefault(true);
00372 
00373     hboxLayout3->addWidget(browse_button);
00374 
00375 
00376     gridLayout->addWidget(groupBox12, 0, 0, 1, 2);
00377 
00378     groupBox = new QGroupBox(MMFF94ConfigurationDialogData);
00379     groupBox->setObjectName(QString::fromUtf8("groupBox"));
00380     groupBox->setAlignment(Qt::AlignHCenter);
00381     vboxLayout = new QVBoxLayout(groupBox);
00382     vboxLayout->setSpacing(5);
00383     vboxLayout->setMargin(5);
00384     vboxLayout->setObjectName(QString::fromUtf8("vboxLayout"));
00385     stretch_box = new QCheckBox(groupBox);
00386     stretch_box->setObjectName(QString::fromUtf8("stretch_box"));
00387     stretch_box->setChecked(true);
00388 
00389     vboxLayout->addWidget(stretch_box);
00390 
00391     bends_box = new QCheckBox(groupBox);
00392     bends_box->setObjectName(QString::fromUtf8("bends_box"));
00393     bends_box->setChecked(true);
00394 
00395     vboxLayout->addWidget(bends_box);
00396 
00397     stretch_bends_box = new QCheckBox(groupBox);
00398     stretch_bends_box->setObjectName(QString::fromUtf8("stretch_bends_box"));
00399     stretch_bends_box->setChecked(true);
00400 
00401     vboxLayout->addWidget(stretch_bends_box);
00402 
00403     torsions_box = new QCheckBox(groupBox);
00404     torsions_box->setObjectName(QString::fromUtf8("torsions_box"));
00405     torsions_box->setChecked(true);
00406 
00407     vboxLayout->addWidget(torsions_box);
00408 
00409     plane_box = new QCheckBox(groupBox);
00410     plane_box->setObjectName(QString::fromUtf8("plane_box"));
00411     plane_box->setChecked(true);
00412 
00413     vboxLayout->addWidget(plane_box);
00414 
00415     vdw_box = new QCheckBox(groupBox);
00416     vdw_box->setObjectName(QString::fromUtf8("vdw_box"));
00417     vdw_box->setChecked(true);
00418 
00419     vboxLayout->addWidget(vdw_box);
00420 
00421     es_box = new QCheckBox(groupBox);
00422     es_box->setObjectName(QString::fromUtf8("es_box"));
00423     es_box->setChecked(true);
00424 
00425     vboxLayout->addWidget(es_box);
00426 
00427 
00428     gridLayout->addWidget(groupBox, 2, 1, 1, 1);
00429 
00430     check_options = new QGroupBox(MMFF94ConfigurationDialogData);
00431     check_options->setObjectName(QString::fromUtf8("check_options"));
00432     check_options->setMinimumSize(QSize(0, 0));
00433     check_options->setAlignment(Qt::AlignHCenter);
00434     vboxLayout1 = new QVBoxLayout(check_options);
00435     vboxLayout1->setSpacing(6);
00436     vboxLayout1->setMargin(9);
00437     vboxLayout1->setObjectName(QString::fromUtf8("vboxLayout1"));
00438     assign_charges_checkBox = new QCheckBox(check_options);
00439     assign_charges_checkBox->setObjectName(QString::fromUtf8("assign_charges_checkBox"));
00440     assign_charges_checkBox->setMinimumSize(QSize(140, 0));
00441     assign_charges_checkBox->setChecked(true);
00442 
00443     vboxLayout1->addWidget(assign_charges_checkBox);
00444 
00445     assign_typenames_checkBox = new QCheckBox(check_options);
00446     assign_typenames_checkBox->setObjectName(QString::fromUtf8("assign_typenames_checkBox"));
00447     assign_typenames_checkBox->setMinimumSize(QSize(165, 0));
00448     assign_typenames_checkBox->setChecked(true);
00449 
00450     vboxLayout1->addWidget(assign_typenames_checkBox);
00451 
00452     assign_types_checkBox = new QCheckBox(check_options);
00453     assign_types_checkBox->setObjectName(QString::fromUtf8("assign_types_checkBox"));
00454     assign_types_checkBox->setMinimumSize(QSize(140, 0));
00455     assign_types_checkBox->setChecked(true);
00456 
00457     vboxLayout1->addWidget(assign_types_checkBox);
00458 
00459     overwrite_charges_checkBox = new QCheckBox(check_options);
00460     overwrite_charges_checkBox->setObjectName(QString::fromUtf8("overwrite_charges_checkBox"));
00461     overwrite_charges_checkBox->setMinimumSize(QSize(155, 0));
00462     overwrite_charges_checkBox->setChecked(true);
00463 
00464     vboxLayout1->addWidget(overwrite_charges_checkBox);
00465 
00466     overwrite_typenames_checkBox = new QCheckBox(check_options);
00467     overwrite_typenames_checkBox->setObjectName(QString::fromUtf8("overwrite_typenames_checkBox"));
00468     overwrite_typenames_checkBox->setMinimumSize(QSize(155, 0));
00469     overwrite_typenames_checkBox->setChecked(true);
00470 
00471     vboxLayout1->addWidget(overwrite_typenames_checkBox);
00472 
00473 
00474     gridLayout->addWidget(check_options, 2, 0, 1, 1);
00475 
00476     nonbonded_cutoff_label_2->setBuddy(nonbonded_cutoff);
00477     nonbonded_cutoff_label_2_2_3->setBuddy(nonbonded_cutoff);
00478     nonbonded_cutoff_label_2_2_3_2->setBuddy(nonbonded_cutoff);
00479     nonbonded_cutoff_label_2_2->setBuddy(nonbonded_cutoff);
00480     nonbonded_cutoff_label_2_2_2->setBuddy(nonbonded_cutoff);
00481     nonbonded_cutoff_label->setBuddy(nonbonded_cutoff);
00482     vdw_cutoff_label->setBuddy(vdw_cutoff);
00483     QWidget::setTabOrder(parameter_file_edit, browse_button);
00484     QWidget::setTabOrder(browse_button, max_unassigned_atoms);
00485     QWidget::setTabOrder(max_unassigned_atoms, assign_charges_checkBox);
00486     QWidget::setTabOrder(assign_charges_checkBox, assign_typenames_checkBox);
00487     QWidget::setTabOrder(assign_typenames_checkBox, assign_types_checkBox);
00488     QWidget::setTabOrder(assign_types_checkBox, overwrite_charges_checkBox);
00489     QWidget::setTabOrder(overwrite_charges_checkBox, overwrite_typenames_checkBox);
00490     QWidget::setTabOrder(overwrite_typenames_checkBox, stretch_box);
00491     QWidget::setTabOrder(stretch_box, bends_box);
00492     QWidget::setTabOrder(bends_box, stretch_bends_box);
00493     QWidget::setTabOrder(stretch_bends_box, torsions_box);
00494     QWidget::setTabOrder(torsions_box, plane_box);
00495     QWidget::setTabOrder(plane_box, vdw_box);
00496     QWidget::setTabOrder(vdw_box, es_box);
00497     QWidget::setTabOrder(es_box, constant_button);
00498     QWidget::setTabOrder(constant_button, distance_button);
00499     QWidget::setTabOrder(distance_button, nonbonded_cutoff);
00500     QWidget::setTabOrder(nonbonded_cutoff, vdw_cutoff);
00501     QWidget::setTabOrder(vdw_cutoff, electrostatic_cutoff);
00502     QWidget::setTabOrder(electrostatic_cutoff, vdw_cuton);
00503     QWidget::setTabOrder(vdw_cuton, electrostatic_cuton);
00504     QWidget::setTabOrder(electrostatic_cuton, close_button);
00505     QWidget::setTabOrder(close_button, cancel_button);
00506     QWidget::setTabOrder(cancel_button, reset_button);
00507 
00508     retranslateUi(MMFF94ConfigurationDialogData);
00509 
00510     QMetaObject::connectSlotsByName(MMFF94ConfigurationDialogData);
00511     } // setupUi
00512 
00513     void retranslateUi(QDialog *MMFF94ConfigurationDialogData)
00514     {
00515     MMFF94ConfigurationDialogData->setWindowTitle(QApplication::translate("MMFF94ConfigurationDialogData", "MMFF94 Options", 0, QApplication::UnicodeUTF8));
00516 
00517 #ifndef QT_NO_TOOLTIP
00518     close_button->setToolTip(QApplication::translate("MMFF94ConfigurationDialogData", "Close and save options", 0, QApplication::UnicodeUTF8));
00519 #endif // QT_NO_TOOLTIP
00520 
00521     close_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "O&K", 0, QApplication::UnicodeUTF8));
00522     close_button->setShortcut(QString());
00523 
00524 #ifndef QT_NO_TOOLTIP
00525     cancel_button->setToolTip(QApplication::translate("MMFF94ConfigurationDialogData", "Close window and discard changes", 0, QApplication::UnicodeUTF8));
00526 #endif // QT_NO_TOOLTIP
00527 
00528     cancel_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "C&ancel", 0, QApplication::UnicodeUTF8));
00529     cancel_button->setShortcut(QString());
00530 
00531 #ifndef QT_NO_TOOLTIP
00532     reset_button->setToolTip(QApplication::translate("MMFF94ConfigurationDialogData", "Reset all settings to default values", 0, QApplication::UnicodeUTF8));
00533 #endif // QT_NO_TOOLTIP
00534 
00535     reset_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Defaults", 0, QApplication::UnicodeUTF8));
00536     reset_button->setShortcut(QString());
00537     cutoff_options->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Switching options", 0, QApplication::UnicodeUTF8));
00538     nonbonded_cutoff->setText(QApplication::translate("MMFF94ConfigurationDialogData", "16.0", 0, QApplication::UnicodeUTF8));
00539     vdw_cutoff->setText(QApplication::translate("MMFF94ConfigurationDialogData", "15.0", 0, QApplication::UnicodeUTF8));
00540     electrostatic_cutoff->setText(QApplication::translate("MMFF94ConfigurationDialogData", "15.0", 0, QApplication::UnicodeUTF8));
00541     nonbonded_cutoff_label_2->setText(QApplication::translate("MMFF94ConfigurationDialogData", "\303\205", 0, QApplication::UnicodeUTF8));
00542     nonbonded_cutoff_label_2_2_3->setText(QApplication::translate("MMFF94ConfigurationDialogData", "\303\205 /", 0, QApplication::UnicodeUTF8));
00543     nonbonded_cutoff_label_2_2_3_2->setText(QApplication::translate("MMFF94ConfigurationDialogData", "\303\205 /", 0, QApplication::UnicodeUTF8));
00544     vdw_cuton->setText(QApplication::translate("MMFF94ConfigurationDialogData", "13.0", 0, QApplication::UnicodeUTF8));
00545     electrostatic_cuton->setText(QApplication::translate("MMFF94ConfigurationDialogData", "13.0", 0, QApplication::UnicodeUTF8));
00546     nonbonded_cutoff_label_2_2->setText(QApplication::translate("MMFF94ConfigurationDialogData", "\303\205", 0, QApplication::UnicodeUTF8));
00547     nonbonded_cutoff_label_2_2_2->setText(QApplication::translate("MMFF94ConfigurationDialogData", "\303\205", 0, QApplication::UnicodeUTF8));
00548     nonbonded_cutoff_label->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Nonbonded cutoff distance", 0, QApplication::UnicodeUTF8));
00549     vdw_cutoff_label->setText(QApplication::translate("MMFF94ConfigurationDialogData", "van der Waals cutoff/cuton distance", 0, QApplication::UnicodeUTF8));
00550     electrostatic_cutoff_label->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Electrostatic cutoff/cuton distance", 0, QApplication::UnicodeUTF8));
00551     dielectric_group->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Dielectric Constant", 0, QApplication::UnicodeUTF8));
00552     constant_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "constant", 0, QApplication::UnicodeUTF8));
00553     distance_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "distance dependent", 0, QApplication::UnicodeUTF8));
00554     groupBox11->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Setup Error Handling", 0, QApplication::UnicodeUTF8));
00555     textLabel1->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Maximum number of unassigned atoms before aborting setup", 0, QApplication::UnicodeUTF8));
00556     max_unassigned_atoms->setText(QApplication::translate("MMFF94ConfigurationDialogData", "10", 0, QApplication::UnicodeUTF8));
00557     groupBox12->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Parameter Set", 0, QApplication::UnicodeUTF8));
00558     Label_10->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Folder", 0, QApplication::UnicodeUTF8));
00559     parameter_file_edit->setText(QApplication::translate("MMFF94ConfigurationDialogData", "MMFF94", 0, QApplication::UnicodeUTF8));
00560 
00561 #ifndef QT_NO_TOOLTIP
00562     browse_button->setToolTip(QApplication::translate("MMFF94ConfigurationDialogData", "Browse your computer for amber file", 0, QApplication::UnicodeUTF8));
00563 #endif // QT_NO_TOOLTIP
00564 
00565     browse_button->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Browse", 0, QApplication::UnicodeUTF8));
00566     groupBox->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Components", 0, QApplication::UnicodeUTF8));
00567     stretch_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Stretches", 0, QApplication::UnicodeUTF8));
00568     bends_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Bends", 0, QApplication::UnicodeUTF8));
00569     stretch_bends_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "StretchBends", 0, QApplication::UnicodeUTF8));
00570     torsions_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Torsions", 0, QApplication::UnicodeUTF8));
00571     plane_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "OutOfPlane", 0, QApplication::UnicodeUTF8));
00572     vdw_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "VDW", 0, QApplication::UnicodeUTF8));
00573     es_box->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Electrostatics", 0, QApplication::UnicodeUTF8));
00574     check_options->setTitle(QApplication::translate("MMFF94ConfigurationDialogData", "Charge and Type Assignment", 0, QApplication::UnicodeUTF8));
00575     assign_charges_checkBox->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Assign charges", 0, QApplication::UnicodeUTF8));
00576     assign_typenames_checkBox->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Assign type names", 0, QApplication::UnicodeUTF8));
00577     assign_types_checkBox->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Assign (numeric) types", 0, QApplication::UnicodeUTF8));
00578     overwrite_charges_checkBox->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Overwrite charges", 0, QApplication::UnicodeUTF8));
00579     overwrite_typenames_checkBox->setText(QApplication::translate("MMFF94ConfigurationDialogData", "Overwrite type names", 0, QApplication::UnicodeUTF8));
00580     Q_UNUSED(MMFF94ConfigurationDialogData);
00581     } // retranslateUi
00582 
00583 };
00584 
00585 namespace Ui {
00586     class MMFF94ConfigurationDialogData: public Ui_MMFF94ConfigurationDialogData {};
00587 } // namespace Ui
00588 
00589 QT_END_NAMESPACE
00590 
00591 #endif // MMFF94CONFIGURATIONDIALOGDATA_H