1 /* +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
2    Copyright (c) 2016-2021 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_bias_ReweightBase_h
23 #define __PLUMED_bias_ReweightBase_h
24 
25 #include "core/ActionWithValue.h"
26 #include "core/ActionWithArguments.h"
27 
28 namespace PLMD {
29 namespace bias {
30 
31 class ReweightBase :
32   public ActionWithValue,
33   public ActionWithArguments
34 {
35 protected:
36 /// The temperature at which you are running the simulation
37   double simtemp;
38 public:
39   static void registerKeywords(Keywords&);
40   explicit ReweightBase(const ActionOptions&ao);
getNumberOfDerivatives()41   unsigned getNumberOfDerivatives() override { return 0; }
buildsWeightStore()42   virtual bool buildsWeightStore() const { return false; }
43   void calculate() override;
calculateWeights(const unsigned & nframes)44   virtual void calculateWeights( const unsigned& nframes ) {}
45   virtual double getLogWeight() = 0;
getWeight(const unsigned & iweight)46   virtual double getWeight( const unsigned& iweight ) const { plumed_error(); }
clearData()47   virtual void clearData() {}
apply()48   void apply() override {}
49 };
50 
51 }
52 }
53 #endif
54