1 #ifndef MCMD_MC_ENERGY_OUTPUT_H 2 #define MCMD_MC_ENERGY_OUTPUT_H 11 #include <mcMd/analyzers/SystemAnalyzer.h> 12 #include <mcMd/mcSimulation/McSystem.h> 44 virtual void readParameters(std::istream& in);
66 template <
class Archive>
67 void serialize(Archive& ar,
const unsigned int version);
72 void sample(
long iStep);
77 virtual void output();
82 std::ofstream outputFile_;
89 template <
class Archive>
A System for use in a Markov chain Monte Carlo simulation.
Analyzer to output total potential energy.
void serialize(Archive &ar, PairSelector &selector, const unsigned int version)
Serialize a PairSelector.
Saving / output archive for binary ostream.
void serialize(Archive &ar, const unsigned int version)
Serialize to/from an archive.
Utility classes for scientific computation.
Template for Analyzer associated with one System.
Saving archive for binary istream.
Single-processor Monte Carlo (MC) and molecular dynamics (MD).
void serialize(Archive &ar, const unsigned int version)
Serialize to/from an archive.