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root/OpenMD/branches/development/src/restraints/RestraintForceManager.cpp
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trunk/src/restraints/RestraintForceManager.cpp (file contents), Revision 1442 by gezelter, Mon May 10 17:28:26 2010 UTC vs.
branches/development/src/restraints/RestraintForceManager.cpp (file contents), Revision 1665 by gezelter, Tue Nov 22 20:38:56 2011 UTC

# Line 36 | Line 36
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).          
39 < * [4]  Vardeman & Gezelter, in progress (2009).                        
39 > * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010).
40 > * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41   */
42  
43   #include <cmath>
# Line 305 | Line 306 | namespace OpenMD {
306      currRestTime_ = currSnapshot_->getTime();
307    }
308  
309 <  void RestraintForceManager::calcForces(bool needPotential, bool needStress){
309 >  void RestraintForceManager::calcForces(){
310  
311 <    ForceManager::calcForces(needPotential, needStress);    
311 >    ForceManager::calcForces();    
312      RealType restPot_local, restPot;
313  
314      restPot_local = doRestraints(1.0);

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