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#include "Integrator.hpp" |
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#include "simError.h" |
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#include <cmath> |
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#include <math.h> |
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template<typename T> ZConstraint<T>::ZConstraint(SimInfo* theInfo, ForceFields* the_ff) |
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: T(theInfo, the_ff), indexOfZConsMols(NULL), fz(NULL), curZPos(NULL), |
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fzOut(NULL), curZconsTime(0), forcePolicy(NULL) |
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} |
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MPI_Bcast(&COM[whichDirection], 1, MPI_DOUBLE_PRECISION, whichNode, MPI_COMM_WORLD); |
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MPI_Bcast(&COM[whichDirection], 1, MPI_DOUBLE, whichNode, MPI_COMM_WORLD); |
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#endif |
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(*parameters)[i].zPos = COM[whichDirection]; |