Package src :: Package propagators :: Package classes :: Module MTS :: Class MOLLY
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Class MOLLY

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PyMTSIntegrator.PyMTSIntegrator --+    
                                  |    
                                MTS --+
                                      |
                                     MOLLY

Parent class for all MOLLY propagators.

Instance Methods [hide private]
 
setMOLLYForceGroups(self)
Initialize MOLLY force fields and energies.
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calculateBondedForces(self)
Evaluate mollified bonded forces.
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Inherited from MTS: finish, init, run