votca 2024-dev
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trajectoryreader.h
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1/*
2 * Copyright 2009-2019 The VOTCA Development Team (http://www.votca.org)
3 *
4 * Licensed under the Apache License, Version 2.0 (the "License");
5 * you may not use this file except in compliance with the License.
6 * You may obtain a copy of the License at
7 *
8 * http://www.apache.org/licenses/LICENSE-2.0
9 *
10 * Unless required by applicable law or agreed to in writing, software
11 * distributed under the License is distributed on an "AS IS" BASIS,
12 * WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
13 * See the License for the specific language governing permissions and
14 * limitations under the License.
15 *
16 */
17
18#ifndef VOTCA_CSG_TRAJECTORYREADER_H
19#define VOTCA_CSG_TRAJECTORYREADER_H
20
21// Standard includes
22#include <string>
23
24// Local VOTCA includes
25#include "fileformatfactory.h"
26#include "topology.h"
27
28namespace votca {
29namespace csg {
30
37 public:
38 virtual ~TrajectoryReader() = default;
40 virtual bool Open(const std::string &file) = 0;
41
42 virtual void Close(){};
43
45 virtual bool FirstFrame(Topology &top) = 0;
47 virtual bool NextFrame(Topology &top) = 0;
48
49 static void RegisterPlugins(void);
50};
51
52// important - singleton pattern, make sure factory is created before accessed
54 static FileFormatFactory<TrajectoryReader> TrjReaderFactory_;
55 return TrjReaderFactory_;
56}
57
58} // namespace csg
59} // namespace votca
60
61#endif /* VOTCA_CSG_TRAJECTORYREADER_H */
topology of the whole system
Definition topology.h:81
trajectoryreader interface
virtual ~TrajectoryReader()=default
virtual bool NextFrame(Topology &top)=0
read in the next frame
virtual bool FirstFrame(Topology &top)=0
read in the first frame
virtual bool Open(const std::string &file)=0
open a trejectory file
FileFormatFactory< TrajectoryReader > & TrjReaderFactory()
base class for all analysis tools
Definition basebead.h:33