|
| static basic::Tracer | protocols::sic_dock::scores::TR ("protocols.sic_dock.scores.TrisBpyScore") |
| |
| static Vec const | protocols::sic_dock::scores::N (2.649,-1.227, 1.777) |
| |
| static Vec const | protocols::sic_dock::scores::CA (3.946,-0.851, 1.187) |
| |
| static Vec const | protocols::sic_dock::scores::C (4.775, 0.037, 2.144) |
| |
| static Vec const | protocols::sic_dock::scores::O (4.410, 0.106, 3.359) |
| |
| static Vec const | protocols::sic_dock::scores::CB (3.569,-0.000, 0.000) |
| |
| static Vec const | protocols::sic_dock::scores::CG (3.018,-0.767,-1.287) |
| |
| static Vec const | protocols::sic_dock::scores::CD (1.984,-0.166,-1.966) |
| |
| static Vec const | protocols::sic_dock::scores::C28 (3.529,-1.952,-1.749) |
| |
| static Vec const | protocols::sic_dock::scores::N5 (0.291,-1.619,-5.187) |
| |
| static Vec const | protocols::sic_dock::scores::N6 (1.455,-0.715,-3.073) |
| |
| static Vec const | protocols::sic_dock::scores::C21 (-0.325,-1.956,-6.336) |
| |
| static Vec const | protocols::sic_dock::scores::C22 (0.087,-3.028,-7.100) |
| |
| static Vec const | protocols::sic_dock::scores::C23 (1.133,-3.793,-6.665) |
| |
| static Vec const | protocols::sic_dock::scores::C24 (1.768,-3.468,-5.482) |
| |
| static Vec const | protocols::sic_dock::scores::C25 (1.336,-2.377,-4.760) |
| |
| static Vec const | protocols::sic_dock::scores::C29 (3.015,-2.510,-2.888) |
| |
| static Vec const | protocols::sic_dock::scores::C30 (1.975,-1.875,-3.536) |
| |
| static Vec const | protocols::sic_dock::scores::FE (0.000, 0.000,-4.157) |
| |
| static Xform const | protocols::sic_dock::scores::bpybb (CA, N, CA, C) |
| |
| static Vec const | protocols::sic_dock::scores::CBlocal (~bpybb *CB) |
| |
| static Mat const | protocols::sic_dock::scores::R3z1 (numeric::z_rotation_matrix_degrees(0.0)) |
| |
| static Mat const | protocols::sic_dock::scores::R3z2 (numeric::z_rotation_matrix_degrees(120.0)) |
| |
| static Mat const | protocols::sic_dock::scores::R3z3 (numeric::z_rotation_matrix_degrees(240.0)) |
| |
| static Mat const | protocols::sic_dock::scores::chiral1 (Mat::cols(1, 0, 0, 0, 1, 0, 0, 0, 1)) |
| |
| static Mat const | protocols::sic_dock::scores::chiral2 (Mat::cols(1, 0, 0, 0, 1, 0, 0, 0,-1)) |
| |
| static Mat const | protocols::sic_dock::scores::chiral3 (Mat::cols(1, 0, 0, 0,-1, 0, 0, 0, 1)) |
| |
| static Mat const | protocols::sic_dock::scores::chiral4 (Mat::cols(1, 0, 0, 0,-1, 0, 0, 0,-1)) |
| |
| static Vec const | protocols::sic_dock::scores::nbr2 (C29) |
| |
| static Vec const | protocols::sic_dock::scores::nbr1 (C22) |
| |
| void | protocols::sic_dock::scores::printbpy (std::ostream &out, Xform const &x, int resi=1000) |
| |
|
| static Vec const | protocols::sic_dock::scores::clash_coords [12] = {CB,CD,C28,N5,N6,C21,C22,C23,C24,C25,C29,C30 } |
| |
| static Mat const | protocols::sic_dock::scores::R3z [3] = { R3z1, R3z2, R3z3 } |
| |
| static Mat const | protocols::sic_dock::scores::chiral [4] = { chiral1, chiral2, chiral3, chiral4 } |
| |
| static Vec const | protocols::sic_dock::scores::nbr [6] = { nbr1, nbr2, R3z2*nbr1, R3z2*nbr2, R3z3*nbr1, R3z3*nbr2 } |
| |