rosetta.core.scoring.etable.coulomb
index
(built-in)

Bindings for core::scoring::etable::coulomb namespace

 
Classes
       
builtins.object
Coulomb

 
class Coulomb(builtins.object)
     Methods defined here:
__init__(...) from builtins.PyCapsule
__init__(*args, **kwargs)
Overloaded function.
 
1. __init__(self : rosetta.core.scoring.etable.coulomb.Coulomb, options : rosetta.core.scoring.methods.EnergyMethodOptions) -> NoneType
 
2. __init__(self : rosetta.core.scoring.etable.coulomb.Coulomb, src : rosetta.core.scoring.etable.coulomb.Coulomb) -> NoneType
__new__(*args, **kwargs) from builtins.type
Create and return a new object.  See help(type) for accurate signature.
assign(...) from builtins.PyCapsule
assign(self : rosetta.core.scoring.etable.coulomb.Coulomb,  : rosetta.core.scoring.etable.coulomb.Coulomb) -> rosetta.core.scoring.etable.coulomb.Coulomb
clone(...) from builtins.PyCapsule
clone(rosetta.core.scoring.etable.coulomb.Coulomb) -> rosetta.core.scoring.etable.coulomb.Coulomb
die(...) from builtins.PyCapsule
die(rosetta.core.scoring.etable.coulomb.Coulomb) -> float
eval_atom_atom_fa_elecE(...) from builtins.PyCapsule
eval_atom_atom_fa_elecE(*args, **kwargs)
Overloaded function.
 
1. eval_atom_atom_fa_elecE(self : rosetta.core.scoring.etable.coulomb.Coulomb, i_xyz : rosetta.numeric.xyzVector_double_t, i_charge : float, j_xyz : rosetta.numeric.xyzVector_double_t, j_charge : float) -> float
 
2. eval_atom_atom_fa_elecE(self : rosetta.core.scoring.etable.coulomb.Coulomb, i_xyz : rosetta.numeric.xyzVector_double_t, i_charge : float, j_xyz : rosetta.numeric.xyzVector_double_t, j_charge : float, d2 : float) -> float
eval_dfa_elecE_dr_over_r(...) from builtins.PyCapsule
eval_dfa_elecE_dr_over_r(self : rosetta.core.scoring.etable.coulomb.Coulomb, dis2 : float, q1 : float, q2 : float) -> float
 
Get the key numeric value for derivative calculations
 i.e. the derivative of energy with respect to distance divided by the distance
initialize(...) from builtins.PyCapsule
initialize(rosetta.core.scoring.etable.coulomb.Coulomb) -> NoneType
 
Initilize constants.
max_dis(...) from builtins.PyCapsule
max_dis(rosetta.core.scoring.etable.coulomb.Coulomb) -> float
max_dis2(...) from builtins.PyCapsule
max_dis2(rosetta.core.scoring.etable.coulomb.Coulomb) -> float
min_dis(...) from builtins.PyCapsule
min_dis(rosetta.core.scoring.etable.coulomb.Coulomb) -> float
min_dis2(...) from builtins.PyCapsule
min_dis2(rosetta.core.scoring.etable.coulomb.Coulomb) -> float
no_dis_dep_die(...) from builtins.PyCapsule
no_dis_dep_die(rosetta.core.scoring.etable.coulomb.Coulomb) -> bool
sigmoid_deps_dr(...) from builtins.PyCapsule
sigmoid_deps_dr(self : rosetta.core.scoring.etable.coulomb.Coulomb, R : float) -> float
sigmoid_eps(...) from builtins.PyCapsule
sigmoid_eps(self : rosetta.core.scoring.etable.coulomb.Coulomb, R : float) -> float
smooth_fa_elec(...) from builtins.PyCapsule
smooth_fa_elec(rosetta.core.scoring.etable.coulomb.Coulomb) -> bool