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root/OpenMD/trunk/src/flucq/FluctuatingChargePropagator.hpp
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Comparing:
branches/development/src/flucq/FluctuatingChargePropagator.hpp (file contents), Revision 1761 by gezelter, Fri Jun 22 20:01:37 2012 UTC vs.
trunk/src/flucq/FluctuatingChargePropagator.hpp (file contents), Revision 1913 by jmichalk, Wed Jul 24 20:00:51 2013 UTC

# Line 35 | Line 35
35   *                                                                      
36   * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).            
37   * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).          
38 < * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).          
38 > * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008).          
39   * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010).
40   * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41   */
# Line 57 | Line 57 | namespace OpenMD {
57    class FluctuatingChargePropagator {
58    public:
59      FluctuatingChargePropagator(SimInfo* info);
60 <    virtual ~FluctuatingChargePropagator(){ }
60 >    virtual ~FluctuatingChargePropagator();
61      virtual void initialize();
62      virtual void updateSizes() = 0;
63      virtual void moveA() = 0;
# Line 71 | Line 71 | namespace OpenMD {
71      SimInfo* info_;
72      ForceManager* forceMan_;
73      bool hasFlucQ_;
74 +    bool initialized_;
75      
76    };
77   }

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