atomgraph_constants.h

// -*-c++-*-
#ifndef STORMM_ATOMGRAPH_CONSTANTS_H
#define STORMM_ATOMGRAPH_CONSTANTS_H
 
#include "copyright.h"
 
namespace stormm {
namespace topology {

constexpr double default_charge_rounding_tol = 0.001;

constexpr double default_charge_precision_inc = 1.1920928955078125E-7;

constexpr double amber_default_elec14_screen = 1.2;
constexpr double amber_default_vdw14_screen = 2.0;
constexpr double charmm_default_elec14_screen = 1.0;
constexpr double charmm_default_vdw14_screen = 1.0;
constexpr double glycam_default_elec14_screen = 1.0;
constexpr double glycam_default_vdw14_screen = 1.0;
  
} // namespace topology
} // namespace stormm
 
#endif