1 #ifndef MCMD_CFB_LINEAR_END_MOVE_H 2 #define MCMD_CFB_LINEAR_END_MOVE_H 11 #include <mcMd/mcMoves/linear/CfbLinear.h> 12 #include <util/containers/DArray.h> 13 #include <util/space/Vector.h> 46 virtual void readParameters(std::istream& in);
A System for use in a Markov chain Monte Carlo simulation.
int nRegrow_
Number of particles at end to attempt to regrow.
DArray< Vector > oldPos_
Array of old positions of temporarily deleted atoms (temporary).
Configuration bias end regrowth move for flexible linear chains.
Base class for configuration bias (CFB) end regrowth moves.
Saving / output archive for binary ostream.
Utility classes for scientific computation.
Dynamically allocatable contiguous array template.
Saving archive for binary istream.
Single-processor Monte Carlo (MC) and molecular dynamics (MD).