int main(int argc, char *argv[]) {
IQmol::IQmolApplication iqmol(argc, argv);
Q_INIT_RESOURCE(IQmol);
// Setup logging;
QsLogging::Logger& logger = QsLogging::Logger::instance();
logger.setLoggingLevel(QsLogging::TraceLevel);
QString const logFile(IQmol::Preferences::LogFilePath());
// Weird scoping going on here
QsLogging::DestinationPtr fileDestination;
if (IQmol::Preferences::LoggingEnabled()) {
fileDestination = QsLogging::DestinationFactory::MakeFileDestination(logFile);
logger.addDestination(fileDestination.get());
#ifdef Q_WS_WIN
if (Preferences::LogFileHidden()) {
int fileHidden(0x2); // Where is FILE_ATTRIBUTE_HIDDEN defined?
WCHAR* fnam = (WCHAR*)logFile.constData();
SetFileAttributes(fnam, fileHidden);
}
#endif
}
QLOG_INFO() << "---------- Session Started ----------";
QLOG_INFO() << "IQmol Version: " << IQMOL_VERSION;
QStringList args(QCoreApplication::arguments());
args.removeFirst();
// This ensures we always have something to open
if (args.isEmpty()) args.push_back("");
iqmol.queueOpenFiles(args);
int ret(iqmol.exec());
QLOG_INFO() << "Return code:" << ret;
QLOG_INFO() << "----------- Session Ended -----------";
return ret;
}
void parse(int argc, char* argv[])
{
QApplication app(argc, argv);
QStringList args(QCoreApplication::arguments());
const QString usage("Usage:\n Parser [-a][-d] filename");
QString input;
bool debugLogFile(false);
bool archiveFile(false);
if (args.size() <= 1) throw usage;
for (int i = 1; i < args.size(); ++i) {
if (args[i] == "-d") {
debugLogFile = true;
}else if (args[i] == "-a") {
archiveFile = true;
}else {
input = args[i];
break;
}
}
if (input.isEmpty()) throw usage;
// Setup logging. There is some weird scoping problem if we add any of the
// following into the if (debugLogFile) clause.
QsLogging::Logger& logger = QsLogging::Logger::instance();
logger.setLoggingLevel(QsLogging::TraceLevel);
logger.setDateStamp(false);
QString logFile(input + ".log");
QsLogging::DestinationPtr fileDestination;
if (debugLogFile) {
fileDestination = QsLogging::DestinationFactory::MakeFileDestination(logFile);
logger.addDestination(fileDestination.get());
qInstallMsgHandler(myMessageHandler);
}
initOpenBabel();
Parser::ParseFile parseFile(input);
parseFile.start();
parseFile.wait();
QStringList errors(parseFile.errors());
if (!errors.isEmpty()) {
qDebug() << "Error parsing file:" << input;
QStringList::iterator iter;
for (iter = errors.begin(); iter != errors.end(); ++iter) {
qDebug() << " " << *iter;
}
return;
}
Data::Bank const& data (parseFile.data());
data.dump();
// Save an IQmol archive
if (archiveFile) {
QString output(input + ".iqmol");
Parser::IQmol iqmol;
iqmol.saveData(output, const_cast<Data::Bank&>(data));
}
}