| 1 | /*
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| 2 |  * Project: MoleCuilder
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| 3 |  * Description: creates and alters molecular systems
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| 4 |  * Copyright (C)  2012 University of Bonn. All rights reserved.
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| 5 |  * 
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| 6 |  *
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| 7 |  *   This file is part of MoleCuilder.
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| 8 |  *
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| 9 |  *    MoleCuilder is free software: you can redistribute it and/or modify
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| 10 |  *    it under the terms of the GNU General Public License as published by
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| 11 |  *    the Free Software Foundation, either version 2 of the License, or
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| 12 |  *    (at your option) any later version.
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| 13 |  *
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| 14 |  *    MoleCuilder is distributed in the hope that it will be useful,
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| 15 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
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| 16 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
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| 17 |  *    GNU General Public License for more details.
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| 18 |  *
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| 19 |  *    You should have received a copy of the GNU General Public License
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| 20 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
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| 21 |  */
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| 22 | 
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| 23 | /*
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| 24 |  * \file mpqc.cpp
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| 25 |  *
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| 26 |  * This file is for a stand-in for mpqc that just prints an output file (.out) which
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| 27 |  * is assumed to be present under the same path as the given input file (.in).
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| 28 |  *
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| 29 |  *  Created on: Apr 19, 2012
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| 30 |  *      Author: heber
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| 31 |  */
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| 32 | 
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| 33 | // include config.h
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| 34 | #ifdef HAVE_CONFIG_H
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| 35 | #include <config.h>
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| 36 | #endif
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| 37 | 
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| 38 | //#include "CodePatterns/MemDebug.hpp"
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| 39 | 
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| 40 | #include <fstream>
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| 41 | #include <iostream>
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| 42 | #include <string>
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| 43 | 
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| 44 | int main(int argc, char **argv)
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| 45 | {
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| 46 |   // check arguments
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| 47 |   if (argc < 2) {
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| 48 |     std::cout << argv[0] << ": error: no molecule given" << std::endl;
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| 49 |     return 134;
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| 50 |   }
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| 51 |   // read given file, first line contains output file
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| 52 |   std::ifstream infile(argv[1]);
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| 53 |   std::string outfilename;
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| 54 |   getline(infile, outfilename);
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| 55 | 
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| 56 |   // try to open file
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| 57 |   std::ifstream file(outfilename.c_str());
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| 58 |   if (file.good()) {
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| 59 |     // print file's contents
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| 60 |     std::string line;
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| 61 |     while (getline(file,line))
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| 62 |       std::cout << line << std::endl;
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| 63 | 
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| 64 |     return 0;
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| 65 |   } else {
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| 66 |     std::cout << argv[0] << ": error: no output file found" << std::endl;
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| 67 |     return 134;
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| 68 |   }
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| 69 | }
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| 70 | 
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