C++ (Cpp) read_state_data_keyの例

コード例 #1

ファイル: colvarbias_abf.cpp プロジェクト: jeffcomer/colvars

std::istream & colvarbias_abf::read_state_data(std::istream& is)
{
  if ( input_prefix.size() > 0 ) {
    cvm::error("ERROR: cannot provide both inputPrefix and a colvars state file.\n", INPUT_ERROR);
  }

  if (! read_state_data_key(is, "samples")) {
    return is;
  }
  if (! samples->read_raw(is)) {
    return is;
  }

  if (! read_state_data_key(is, "gradient")) {
    return is;
  }
  if (! gradients->read_raw(is)) {
    return is;
  }
  if (b_integrate) {
    // Update divergence to account for restart data
    pmf->set_div();
  }

  if (b_CZAR_estimator) {

    if (! read_state_data_key(is, "z_samples")) {
      return is;
    }
    if (! z_samples->read_raw(is)) {
      return is;
    }

    if (! read_state_data_key(is, "z_gradient")) {
      return is;
    }
    if (! z_gradients->read_raw(is)) {
      return is;
    }
  }

  return is;
}

コード例 #2

std::istream & colvarbias_abf::read_state_data(std::istream& is)
{
  if ( input_prefix.size() > 0 ) {
    cvm::error("ERROR: cannot provide both inputPrefix and a colvars state file.\n", INPUT_ERROR);
  }

  if (! read_state_data_key(is, "samples")) {
    return is;
  }
  if (! samples->read_raw(is)) {
    return is;
  }

  if (! read_state_data_key(is, "gradient")) {
    return is;
  }
  if (! gradients->read_raw(is)) {
    return is;
  }

  if (z_gradients) {

    if (! read_state_data_key(is, "z_samples")) {
      return is;
    }
    if (! z_samples->read_raw(is)) {
      return is;
    }

    if (! read_state_data_key(is, "z_gradient")) {
      return is;
    }
    if (! z_gradients->read_raw(is)) {
      return is;
    }
  }

  return is;
}