C++ (Cpp) _gmx_selelem_can_estimate_cover Exemples

Exemple #1

Fichier : selection.c Projet : aar2163/GROMACS

/*!
 * \param[in] sel  Selection to initialize.
 * \param[in] type Type of covered fraction required.
 * \returns   TRUE if the covered fraction can be calculated for the selection,
 *   FALSE otherwise.    
 */
bool
gmx_ana_selection_init_coverfrac(gmx_ana_selection_t *sel, e_coverfrac_t type)
{
    sel->cfractype = type;
    if (type == CFRAC_NONE || !sel->selelem)
    {
        sel->bCFracDyn = FALSE;
    }
    else if (!_gmx_selelem_can_estimate_cover(sel->selelem))
    {
        sel->cfractype = CFRAC_NONE;
        sel->bCFracDyn = FALSE;
    }
    else
    {
        sel->bCFracDyn = TRUE;
    }
    sel->cfrac     = sel->bCFracDyn ? 0.0 : 1.0;
    sel->avecfrac  = sel->cfrac;
    return type == CFRAC_NONE || sel->cfractype != CFRAC_NONE;
}

Exemple #2

Fichier : selection.cpp Projet : ElsevierSoftwareX/SOFTX-D-15-00003

bool
SelectionData::initCoveredFraction(e_coverfrac_t type)
{
    coveredFractionType_ = type;
    if (type == CFRAC_NONE)
    {
        bDynamicCoveredFraction_ = false;
    }
    else if (!_gmx_selelem_can_estimate_cover(rootElement()))
    {
        coveredFractionType_     = CFRAC_NONE;
        bDynamicCoveredFraction_ = false;
    }
    else
    {
        bDynamicCoveredFraction_ = true;
    }
    coveredFraction_        = bDynamicCoveredFraction_ ? 0.0 : 1.0;
    averageCoveredFraction_ = coveredFraction_;
    return type == CFRAC_NONE || coveredFractionType_ != CFRAC_NONE;
}