| 1 | + | /* | 
| 2 | + | * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved. | 
| 3 | + | * | 
| 4 | + | * The University of Notre Dame grants you ("Licensee") a | 
| 5 | + | * non-exclusive, royalty free, license to use, modify and | 
| 6 | + | * redistribute this software in source and binary code form, provided | 
| 7 | + | * that the following conditions are met: | 
| 8 | + | * | 
| 9 | + | * 1. Acknowledgement of the program authors must be made in any | 
| 10 | + | *    publication of scientific results based in part on use of the | 
| 11 | + | *    program.  An acceptable form of acknowledgement is citation of | 
| 12 | + | *    the article in which the program was described (Matthew | 
| 13 | + | *    A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher | 
| 14 | + | *    J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented | 
| 15 | + | *    Parallel Simulation Engine for Molecular Dynamics," | 
| 16 | + | *    J. Comput. Chem. 26, pp. 252-271 (2005)) | 
| 17 | + | * | 
| 18 | + | * 2. Redistributions of source code must retain the above copyright | 
| 19 | + | *    notice, this list of conditions and the following disclaimer. | 
| 20 | + | * | 
| 21 | + | * 3. Redistributions in binary form must reproduce the above copyright | 
| 22 | + | *    notice, this list of conditions and the following disclaimer in the | 
| 23 | + | *    documentation and/or other materials provided with the | 
| 24 | + | *    distribution. | 
| 25 | + | * | 
| 26 | + | * This software is provided "AS IS," without a warranty of any | 
| 27 | + | * kind. All express or implied conditions, representations and | 
| 28 | + | * warranties, including any implied warranty of merchantability, | 
| 29 | + | * fitness for a particular purpose or non-infringement, are hereby | 
| 30 | + | * excluded.  The University of Notre Dame and its licensors shall not | 
| 31 | + | * be liable for any damages suffered by licensee as a result of | 
| 32 | + | * using, modifying or distributing the software or its | 
| 33 | + | * derivatives. In no event will the University of Notre Dame or its | 
| 34 | + | * licensors be liable for any lost revenue, profit or data, or for | 
| 35 | + | * direct, indirect, special, consequential, incidental or punitive | 
| 36 | + | * damages, however caused and regardless of the theory of liability, | 
| 37 | + | * arising out of the use of or inability to use software, even if the | 
| 38 | + | * University of Notre Dame has been advised of the possibility of | 
| 39 | + | * such damages. | 
| 40 | + | */ | 
| 41 | + |  | 
| 42 | + |  | 
| 43 |  | #include "utils/Utility.hpp" | 
| 2 | – | #include <vector> | 
| 3 | – | #include <iostream> | 
| 4 | – | #include <math.h> | 
| 5 | – | using namespace std; | 
| 44 |  |  | 
| 45 | < | double dotProduct(vector<double>& v1, vector<double>& v2){ | 
| 8 | < | double sum; | 
| 45 | > | namespace oopse { | 
| 46 |  |  | 
| 47 | < | sum = 0; | 
| 47 | > | bool replaceWithWildCard(std::vector<std::vector<std::string>::iterator>& cont, | 
| 48 | > | std::vector<std::string>& sequence, std::vector<std::string>& result, const std::string& wildCard) { | 
| 49 | > | if (cont.size() > sequence.size()) { | 
| 50 | > | std::cerr << "the size of iterator container is greater than the size of sequence"; | 
| 51 | > | } | 
| 52 |  |  | 
| 53 | < | if(v1.size() != v2.size()){ | 
| 54 | < | cerr << "Utility Error: dimension of two vectors are not matched" << endl; | 
| 55 | < | exit(-1); | 
| 56 | < | } | 
| 57 | < |  | 
| 58 | < | for(int  i = 0; i < v1.size(); i++) | 
| 59 | < | sum += v1[i]*v2[i]; | 
| 60 | < | return sum; | 
| 61 | < | } | 
| 53 | > | bool hasMoreCombination = next_combination(cont, sequence.begin(), sequence.end()); | 
| 54 | > | if (hasMoreCombination) { | 
| 55 | > | result.clear(); | 
| 56 | > | result.insert(result.begin(), sequence.size(), wildCard); | 
| 57 | > | std::vector<std::vector<std::string>::iterator>::iterator i; | 
| 58 | > | for ( i = cont.begin(); i != cont.end(); i++){ | 
| 59 | > | result[*i - sequence.begin()] = **i; | 
| 60 | > | } | 
| 61 | > | } | 
| 62 |  |  | 
| 63 | < | double norm2(vector<double>& x){ | 
| 64 | < | return sqrt(dotProduct(x, x)); | 
| 65 | < | } | 
| 63 | > | return hasMoreCombination; | 
| 64 | > |  | 
| 65 | > | }//end replaceWildCard | 
| 66 | > |  | 
| 67 | > | } |