| [23d10f] | 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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| [94d5ac6] | 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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| [23d10f] | 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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| [9eb71b3] | 38 | //#include "CodePatterns/MemDebug.hpp" | 
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| [23d10f] | 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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