[52baf9] | 1 | /** \file FormatParserStorage.hpp
|
---|
| 2 | *
|
---|
| 3 | * date: Jun, 22 2010
|
---|
| 4 | * author: heber
|
---|
| 5 | *
|
---|
| 6 | */
|
---|
| 7 |
|
---|
| 8 | #ifndef FORMATPARSERSTORAGE_HPP_
|
---|
| 9 | #define FORMATPARSERSTORAGE_HPP_
|
---|
| 10 |
|
---|
| 11 | // include config.h
|
---|
| 12 | #ifdef HAVE_CONFIG_H
|
---|
| 13 | #include <config.h>
|
---|
| 14 | #endif
|
---|
| 15 |
|
---|
[ad011c] | 16 | #include "CodePatterns/Singleton.hpp"
|
---|
[52baf9] | 17 |
|
---|
| 18 | #include <string>
|
---|
[5c6946] | 19 | #include <map>
|
---|
[52baf9] | 20 | #include <vector>
|
---|
| 21 |
|
---|
[73916f] | 22 | class atom;
|
---|
[52baf9] | 23 | class FormatParser;
|
---|
[dc0d21] | 24 | class MpqcParser;
|
---|
[bb6193] | 25 | class PdbParser;
|
---|
[dc0d21] | 26 | class PcpParser;
|
---|
| 27 | class TremoloParser;
|
---|
| 28 | class XyzParser;
|
---|
[52baf9] | 29 |
|
---|
| 30 | // enum has to be outside of class for operator++ to be possible
|
---|
[bb6193] | 31 | enum ParserTypes { mpqc, pcp, pdb, tremolo, xyz, ParserTypes_end, ParserTypes_begin = mpqc };
|
---|
[52baf9] | 32 | typedef enum ParserTypes ParserTypes;
|
---|
| 33 |
|
---|
[dc0d21] | 34 | ParserTypes &operator++(ParserTypes &type);
|
---|
[52baf9] | 35 |
|
---|
| 36 | class FormatParserStorage : public Singleton<FormatParserStorage> {
|
---|
| 37 | friend class Singleton<FormatParserStorage>;
|
---|
| 38 | public:
|
---|
| 39 |
|
---|
[dc0d21] | 40 | void addMpqc();
|
---|
| 41 | void addPcp();
|
---|
[bb6193] | 42 | void addPdb();
|
---|
[dc0d21] | 43 | void addTremolo();
|
---|
| 44 | void addXyz();
|
---|
[5c6946] | 45 | bool add(std::string type);
|
---|
| 46 | bool add(ParserTypes type);
|
---|
[dc0d21] | 47 |
|
---|
[73916f] | 48 | bool load(std::istream &input, std::string suffix);
|
---|
| 49 | bool save(std::ostream &output, std::string suffix, const std::vector<atom *> &atoms);
|
---|
| 50 | bool saveSelectedAtoms(std::ostream &output, std::string suffix);
|
---|
| 51 | bool saveSelectedMolecules(std::ostream &output, std::string suffix);
|
---|
| 52 | bool saveWorld(std::ostream &output, std::string suffix);
|
---|
[dc0d21] | 53 | MpqcParser &getMpqc();
|
---|
| 54 | PcpParser &getPcp();
|
---|
[bb6193] | 55 | PdbParser &getPdb();
|
---|
[dc0d21] | 56 | TremoloParser &getTremolo();
|
---|
| 57 | XyzParser &getXyz();
|
---|
[52baf9] | 58 |
|
---|
[a42054] | 59 | ParserTypes getTypeFromName(std::string type);
|
---|
| 60 | ParserTypes getTypeFromSuffix(std::string type);
|
---|
[5c6946] | 61 |
|
---|
[52baf9] | 62 | void SetOutputPrefixForAll(std::string &_prefix);
|
---|
| 63 | void SaveAll();
|
---|
| 64 |
|
---|
| 65 | private:
|
---|
| 66 | // private constructors as this is a singleton
|
---|
| 67 | FormatParserStorage();
|
---|
| 68 | ~FormatParserStorage();
|
---|
| 69 |
|
---|
| 70 | // list of allocated parsers
|
---|
| 71 | std::vector<FormatParser *> ParserList;
|
---|
| 72 |
|
---|
[60239f] | 73 | // list of allocated strams
|
---|
| 74 | std::vector<std::ofstream *> ParserStream;
|
---|
| 75 |
|
---|
[52baf9] | 76 | // which parser is already present
|
---|
| 77 | std::vector<bool> ParserPresent;
|
---|
| 78 |
|
---|
| 79 | // default suffix of each parser type
|
---|
[a42054] | 80 | std::map<ParserTypes, std::string> ParserSuffixes;
|
---|
| 81 | std::map<std::string, ParserTypes> ParserLookupSuffixes;
|
---|
[52baf9] | 82 |
|
---|
[5c6946] | 83 | // function pointers to each add...()
|
---|
| 84 | std::map< ParserTypes, void (FormatParserStorage::*)() > ParserAddFunction;
|
---|
| 85 |
|
---|
| 86 | // type name of each parser type and reverse lookup
|
---|
| 87 | std::map<ParserTypes, std::string> ParserNames;
|
---|
| 88 | std::map<std::string, ParserTypes> ParserLookupNames;
|
---|
| 89 |
|
---|
| 90 |
|
---|
[52baf9] | 91 | // prefix of the filenames to use on save
|
---|
| 92 | std::string prefix;
|
---|
| 93 | };
|
---|
| 94 |
|
---|
| 95 | #endif // FORMATPARSERSTORAGE_HPP_
|
---|