| # | Line 22 | Line 22 | const double tol = 1.0e-6; | |
|---|---|---|
| 22 | const int maxIteration = 300; | |
| 23 | const double tol = 1.0e-6; | |
| 24 | ||
| 25 | < | class RattleFramework; |
| 25 | > | class VelVerletConsFramework; |
| 26 | template<typename T = BaseIntegrator> class Integrator : public T { | |
| 27 | ||
| 28 | public: | |
| # | Line 65 | Line 65 | template<typename T = BaseIntegrator> class Integrator | |
| 65 | Molecule* molecules; | |
| 66 | int nMols; | |
| 67 | ||
| 68 | < | RattleFramework* rattle; |
| 68 | > | VelVerletConsFramework* consFramework; |
| 69 | ||
| 70 | //int isConstrained; // boolean to know whether the systems contains constraints. | |
| 71 | //int nConstrained; // counter for number of constraints | |
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