Rosetta 3.4
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#include <CartesianBondedEnergy.hh>
Public Member Functions | |
BondAngleDatabase (Real k_ang) | |
void | lookup (core::chemical::ResidueType const &restype, int atm1, int atm2, int atm3, Real &Ktheta, Real &d0) |
core::scoring::methods::BondAngleDatabase::BondAngleDatabase | ( | Real | k_ang | ) |
References core::scoring::methods::K_ANGLE, and core::scoring::methods::TR().
void core::scoring::methods::BondAngleDatabase::lookup | ( | core::chemical::ResidueType const & | restype, |
int | atm1, | ||
int | atm2, | ||
int | atm3, | ||
Real & | Ktheta, | ||
Real & | theta0 | ||
) |
BondAngle Database
References core::chemical::ResidueType::aa(), core::chemical::aa_ala, core::chemical::aa_gly, core::chemical::aa_pro, core::chemical::ResidueType::atom_name(), core::conformation::ResidueFactory::create_residue(), core::chemical::CUTPOINT_LOWER, core::chemical::CUTPOINT_UPPER, core::scoring::methods::get_restag(), and core::chemical::ResidueType::has_variant_type().