Line data Source code
1 : /* +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
2 : Copyright (c) 2014-2019 The plumed team
3 : (see the PEOPLE file at the root of the distribution for a list of names)
4 :
5 : See http://www.plumed.org for more information.
6 :
7 : This file is part of plumed, version 2.
8 :
9 : plumed is free software: you can redistribute it and/or modify
10 : it under the terms of the GNU Lesser General Public License as published by
11 : the Free Software Foundation, either version 3 of the License, or
12 : (at your option) any later version.
13 :
14 : plumed is distributed in the hope that it will be useful,
15 : but WITHOUT ANY WARRANTY; without even the implied warranty of
16 : MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
17 : GNU Lesser General Public License for more details.
18 :
19 : You should have received a copy of the GNU Lesser General Public License
20 : along with plumed. If not, see <http://www.gnu.org/licenses/>.
21 : +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ */
22 : #ifndef __PLUMED_vesselbase_LessThan_h
23 : #define __PLUMED_vesselbase_LessThan_h
24 :
25 : #include "FunctionVessel.h"
26 : #include "tools/SwitchingFunction.h"
27 : #include "ActionWithVessel.h"
28 :
29 : namespace PLMD {
30 : namespace vesselbase {
31 :
32 118 : class LessThan : public FunctionVessel {
33 : private:
34 : SwitchingFunction sf;
35 : public:
36 : static void registerKeywords( Keywords& keys );
37 : static void reserveKeyword( Keywords& keys );
38 : explicit LessThan( const VesselOptions& da );
39 : std::string value_descriptor();
40 : double calcTransform( const double& val, double& dv ) const ;
41 : double getCutoff();
42 : };
43 :
44 : }
45 : }
46 : #endif
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