| 35 |  | * | 
| 36 |  | * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). | 
| 37 |  | * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). | 
| 38 | < | * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). | 
| 38 | > | * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). | 
| 39 |  | * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010). | 
| 40 |  | * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). | 
| 41 |  | */ | 
| 42 |  |  | 
| 43 |  | /** | 
| 44 | < | * @file basic_ifstrstream.cpp | 
| 44 | > | * @file ifstrstream.cpp | 
| 45 |  | * @author Teng Lin | 
| 46 |  | * @date 10/14/2004 | 
| 47 |  | * @version 1.0 | 
| 48 |  | */ | 
| 49 |  |  | 
| 50 | – | #include "io/ifstrstream.hpp" | 
| 51 | – |  | 
| 50 |  | #ifdef IS_MPI | 
| 51 |  | #include <mpi.h> | 
| 52 |  | #endif | 
| 53 |  |  | 
| 54 | + | #include "io/ifstrstream.hpp" | 
| 55 | + |  | 
| 56 |  | namespace OpenMD { | 
| 57 |  |  | 
| 58 |  | /**  Constructs an object of class ifstream.  */ | 
| 72 |  |  | 
| 73 |  | /** | 
| 74 |  | * Explicit constructor | 
| 75 | < | * @filename String containing the name of the file to be opened | 
| 76 | < | * @mode Flags describing the requested i/o mode for the file, default value is ios_base::in | 
| 77 | < | * @checkFilename Flags indicating checking the file name in parallel | 
| 75 | > | * @param filename String containing the name of the file to be opened | 
| 76 | > | * @param mode Flags describing the requested i/o mode for the file, default value is ios_base::in | 
| 77 | > | * @param checkFilename Flags indicating checking the file name in parallel | 
| 78 |  | */ | 
| 79 |  | #ifdef IS_MPI | 
| 80 |  | ifstrstream::ifstrstream(const char* filename, std::ios_base::openmode mode, bool checkFilename) | 
| 103 |  | * Opens a file and associats a buffer with the specified file to perform the i/o operations | 
| 104 |  | * (single mode). Master reads a file and brocasts its content to the other slave nodes. After | 
| 105 |  | * brocasting, every nodes fall back to stringstream (parallel mode). | 
| 106 | < | * @filename String containing the name of the file to be opened | 
| 107 | < | * @mode Flags describing the requested i/o mode for the file | 
| 108 | < | * @checkFilename Flags indicating checking the file name in parallel | 
| 106 | > | * @param filename String containing the name of the file to be opened | 
| 107 | > | * @param mode Flags describing the requested i/o mode for the file | 
| 108 | > | * @param checkFilename Flags indicating checking the file name in parallel | 
| 109 |  | */ | 
| 110 |  | void ifstrstream::open(const char* filename, std::ios_base::openmode mode, bool checkFilename){ | 
| 111 |  |  | 
| 160 |  | * Internal function used to open the file | 
| 161 |  | * @return true if succesfully opens a file (single mode) or gets the file content (parallel mode) | 
| 162 |  | * otherwise return false | 
| 163 | < | * @filename String containing the name of the file to be opened | 
| 164 | < | * @mode Flags describing the requested i/o mode for the file | 
| 163 | > | * @param filename String containing the name of the file to be opened | 
| 164 | > | * @param mode Flags describing the requested i/o mode for the file | 
| 165 | > | * @param checkFilename Flags indicating checking the file name in parallel | 
| 166 |  | * @todo use try - catch syntax to make the program more readable | 
| 167 |  | */ | 
| 168 |  |  | 
| 222 |  |  | 
| 223 |  | if (fileSize < 0) { | 
| 224 |  | fin.close(); | 
| 225 | < | delete fbuf; | 
| 225 | > | delete[] fbuf; | 
| 226 |  |  | 
| 227 |  | return false; | 
| 228 |  | } | 
| 234 |  | //close the file and delete the buffer | 
| 235 |  | fin.close(); | 
| 236 |  | internalStringBuf_.str(fbuf); | 
| 237 | < | delete [] fbuf; | 
| 237 | > | delete[] fbuf; | 
| 238 |  | }else{ | 
| 239 |  | fileSize = FileNotExists; | 
| 240 |  | MPI::COMM_WORLD.Bcast(&fileSize, 1, MPI::LONG, masterNode); | 
| 256 |  | else | 
| 257 |  | diffFilename = 1; | 
| 258 |  |  | 
| 259 | < | delete masterFilename; | 
| 259 | > | delete[] masterFilename; | 
| 260 |  |  | 
| 261 |  | MPI::COMM_WORLD.Allreduce(&diffFilename, &error, 1, MPI::INT, MPI::SUM); | 
| 262 |  |  |