CombiningParticlePotentialParsing
Last change
on this file since ff4fff9 was 305e7e, checked in by Frederik Heber <heber@…>, 14 years ago |
FIX: Type is actually spelled type with TREMOLO.
- corrected in TremoloParser.
- TESTFIX: the following tests has to be changed accordingly:
|
-
Property mode
set to
100644
|
File size:
1.1 KB
|
Line | |
---|
1 | /*
|
---|
2 | * TremoloAtomInfoContainer.hpp
|
---|
3 | *
|
---|
4 | * Created on: Dec 7, 2010
|
---|
5 | * Author: heber
|
---|
6 | */
|
---|
7 |
|
---|
8 | #ifndef TREMOLOATOMINFOCONTAINER_HPP_
|
---|
9 | #define TREMOLOATOMINFOCONTAINER_HPP_
|
---|
10 |
|
---|
11 | // include config.h
|
---|
12 | #ifdef HAVE_CONFIG_H
|
---|
13 | #include <config.h>
|
---|
14 | #endif
|
---|
15 |
|
---|
16 |
|
---|
17 | #include <string>
|
---|
18 | #include <vector>
|
---|
19 |
|
---|
20 | #include "TremoloKey.hpp"
|
---|
21 |
|
---|
22 | /**
|
---|
23 | * Holds tremolo-specific information which is not store in the atom class.
|
---|
24 | */
|
---|
25 | class TremoloAtomInfoContainer {
|
---|
26 | public:
|
---|
27 | TremoloAtomInfoContainer();
|
---|
28 | void set(TremoloKey::atomDataKey key, std::string value);
|
---|
29 | std::string get(TremoloKey::atomDataKey key) const;
|
---|
30 | std::string F;
|
---|
31 | std::string stress;
|
---|
32 | std::string imprData;
|
---|
33 | std::string GroupMeasureTypeNo;
|
---|
34 | std::string type;
|
---|
35 | std::string extType;
|
---|
36 | std::string name;
|
---|
37 | std::string resName;
|
---|
38 | std::string chainID;
|
---|
39 | std::string resSeq;
|
---|
40 | std::string occupancy;
|
---|
41 | std::string tempFactor;
|
---|
42 | std::string segID;
|
---|
43 | std::string Charge;
|
---|
44 | std::string charge;
|
---|
45 | std::string GrpTypeNo;
|
---|
46 | std::string torsion;
|
---|
47 | std::vector<int> neighbors;
|
---|
48 | bool neighbors_processed;
|
---|
49 | };
|
---|
50 |
|
---|
51 | std::ostream& operator<<(std::ostream& out, const TremoloAtomInfoContainer&);
|
---|
52 |
|
---|
53 | #endif /* TREMOLOATOMINFOCONTAINER_HPP_ */
|
---|
Note:
See
TracBrowser
for help on using the repository browser.