simple_calculators

Bindings for core::pose::metrics::simple_calculators namespace

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator

Bases: StructureDependentCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, chain1_number: int, chain2_number: int) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, chain1_letter: str, chain2_letter: str) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator

C++: core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator::operator=(const class core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator &) –> class core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator) → None

C++: core::pose::metrics::StructureDependentCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceDefinitionCalculator::save(class cereal::BinaryOutputArchive &) const –> void

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator

Bases: EnergyDependentCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, NameOfInterfaceNeighborDefinitionCalculator: str) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, NameOfInterfaceNeighborDefinitionCalculator: str, score_types_to_ignore: pyrosetta.rosetta.utility.vector1_core_scoring_ScoreType) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, chain1_number: int, chain2_number: int) -> None

  4. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, chain1_letter: str, chain2_letter: str) -> None

  5. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator) -> None

  6. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator

C++: core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator::operator=(const class core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator &) –> class core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.EnergyDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::EnergyDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.EnergyDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::EnergyDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.EnergyDependentCalculator) → None

C++: core::pose::metrics::EnergyDependentCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceDeltaEnergeticsCalculator, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceDeltaEnergeticsCalculator::save(class cereal::BinaryOutputArchive &) const –> void

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator

Bases: InterfaceDefinitionCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, chain1_number: int, chain2_number: int) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, chain1_letter: str, chain2_letter: str) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator) -> None

  4. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator

C++: core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator::operator=(const class core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator &) –> class core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator) → None

C++: core::pose::metrics::StructureDependentCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceNeighborDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceNeighborDefinitionCalculator::save(class cereal::BinaryOutputArchive &) const –> void

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator

Bases: InterfaceDefinitionCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, chain1_number: int, chain2_number: int) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, chain1_letter: str, chain2_letter: str) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator) -> None

  4. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator

C++: core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator::operator=(const class core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator &) –> class core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator) → None

C++: core::pose::metrics::StructureDependentCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.InterfaceSasaDefinitionCalculator, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::InterfaceSasaDefinitionCalculator::save(class cereal::BinaryOutputArchive &) const –> void

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2

Bases: StructureDependentCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, probe_r: float) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2) -> None

  4. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2

C++: core::pose::metrics::simple_calculators::SasaCalculator2::operator=(const class core::pose::metrics::simple_calculators::SasaCalculator2 &) –> class core::pose::metrics::simple_calculators::SasaCalculator2 &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::SasaCalculator2::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::SasaCalculator2::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator) → None

C++: core::pose::metrics::StructureDependentCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculator2, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::SasaCalculator2::save(class cereal::BinaryOutputArchive &) const –> void

class pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy

Bases: StructureDependentCalculator

__init__(*args, **kwargs)

Overloaded function.

  1. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy) -> None

  2. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, probe_r: float) -> None

  3. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy) -> None

  4. __init__(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, arg0: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy) -> None

_pybind11_conduit_v1_()
assign(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, : pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy) → pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy

C++: core::pose::metrics::simple_calculators::SasaCalculatorLegacy::operator=(const class core::pose::metrics::simple_calculators::SasaCalculatorLegacy &) –> class core::pose::metrics::simple_calculators::SasaCalculatorLegacy &

clone(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy) → pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator

C++: core::pose::metrics::simple_calculators::SasaCalculatorLegacy::clone() const –> class std::shared_ptr<class core::pose::metrics::PoseMetricCalculator>

get(*args, **kwargs)

Overloaded function.

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, val: pyrosetta.rosetta.basic.MetricValueBase, this_pose: pyrosetta.rosetta.core.pose.Pose) -> None

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, class basic::MetricValueBase &, const class core::pose::Pose &) –> void

  1. get(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator, key: str, this_pose: pyrosetta.rosetta.core.pose.Pose) -> str

C++: core::pose::metrics::StructureDependentCalculator::get(const std::string &, const class core::pose::Pose &) –> std::string

load(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, arc: pyrosetta.rosetta.cereal.BinaryInputArchive) → None

C++: core::pose::metrics::simple_calculators::SasaCalculatorLegacy::load(class cereal::BinaryInputArchive &) –> void

notify_energy_change(self: pyrosetta.rosetta.core.pose.metrics.PoseMetricCalculator) → None

C++: core::pose::metrics::PoseMetricCalculator::notify_energy_change() –> void

notify_structure_change(self: pyrosetta.rosetta.core.pose.metrics.StructureDependentCalculator) → None

C++: core::pose::metrics::StructureDependentCalculator::notify_structure_change() –> void

save(self: pyrosetta.rosetta.core.pose.metrics.simple_calculators.SasaCalculatorLegacy, arc: pyrosetta.rosetta.cereal.BinaryOutputArchive) → None

C++: core::pose::metrics::simple_calculators::SasaCalculatorLegacy::save(class cereal::BinaryOutputArchive &) const –> void