Exemplos de init_cvc_requires em C++ (Cpp)

Exemplo n.º 1

Arquivo: colvarcomp.cpp Projeto: BrianMoths/lammps

colvar::cvc::cvc()
  : sup_coeff(1.0),
    sup_np(1),
    b_periodic(false),
    b_try_scalable(true)
{
  init_cvc_requires();
}

Exemplo n.º 2

Arquivo: colvarcomp.cpp Projeto: hadress/lammps

colvar::cvc::cvc(std::string const &conf)
  : sup_coeff(1.0),
    sup_np(1),
    b_periodic(false),
    b_try_scalable(true)
{
  if (cvm::debug())
    cvm::log("Initializing cvc base object.\n");

  init_cvc_requires();

  if (get_keyval(conf, "name", this->name, std::string(""), parse_silent)) {
    // Temporary description until child object is initialized
    description = "cvc " + name;
  } else {
    description = "uninitialized cvc";
  }

  get_keyval(conf, "componentCoeff", sup_coeff, 1.0);
  get_keyval(conf, "componentExp", sup_np, 1);

  get_keyval(conf, "period", period, 0.0);
  get_keyval(conf, "wrapAround", wrap_center, 0.0);

  // All cvcs implement this
  provide(f_cvc_debug_gradient);
  {
    bool b_debug_gradient;
    get_keyval(conf, "debugGradients", b_debug_gradient, false, parse_silent);
    if (b_debug_gradient) enable(f_cvc_debug_gradient);
  }

  // Attempt scalable calculations when in parallel? (By default yes, if available)
  get_keyval(conf, "scalable", b_try_scalable, true);

  if (cvm::debug())
    cvm::log("Done initializing cvc base object.\n");
}