| |
- builtins.object
-
- Mutant
- MutationData
- PointMutScanDriver
-
- AlterSpecDisruptionDriver
class AlterSpecDisruptionDriver(PointMutScanDriver) |
|
this subclass of Ron's PointMutScanDriver exists to tweak one aspect of his code: instead of looking for total-energy-stabilizing mutations, it looks for binding-energy-DEstabilizing point & pair mutations. |
|
- Method resolution order:
- AlterSpecDisruptionDriver
- PointMutScanDriver
- builtins.object
Methods defined here:
- __init__(...) from builtins.PyCapsule
- __init__(*args, **kwargs)
Overloaded function.
1. __init__(self : handle, pdb_file_names : rosetta.utility.vector1_std_string, double_mutant_scan : bool, list_file : str, output_mutant_structures : bool) -> NoneType
2. __init__(handle, rosetta.protocols.pmut_scan.AlterSpecDisruptionDriver) -> 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.protocols.pmut_scan.AlterSpecDisruptionDriver, : rosetta.protocols.pmut_scan.AlterSpecDisruptionDriver) -> rosetta.protocols.pmut_scan.AlterSpecDisruptionDriver
- reject_mutant(...) from builtins.PyCapsule
- reject_mutant(self : rosetta.protocols.pmut_scan.AlterSpecDisruptionDriver, mutant : protocols::pmut_scan::Mutant, pose : rosetta.core.pose.Pose) -> bool
offers a chance for child classes to inject mutant selection logic
- score(...) from builtins.PyCapsule
- score(self : rosetta.protocols.pmut_scan.AlterSpecDisruptionDriver, pose : rosetta.core.pose.Pose) -> float
return a score that is a ddG of binding, rather than a ddG of the interface. It returns a reversed value because this class wants to find DEstabilizing mutations.
Methods inherited from PointMutScanDriver:
- calculate_neighbor_table(...) from builtins.PyCapsule
- calculate_neighbor_table(self : rosetta.protocols.pmut_scan.PointMutScanDriver, pose : rosetta.core.pose.Pose, neighbors : rosetta.utility.vector1_utility_vector1_bool_std_allocator_bool_t) -> NoneType
- fill_mutations_list(...) from builtins.PyCapsule
- fill_mutations_list(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- get_scorefxn(...) from builtins.PyCapsule
- get_scorefxn(rosetta.protocols.pmut_scan.PointMutScanDriver) -> rosetta.core.scoring.ScoreFunction
accessor for scorefxn_ now that it is private member data
- go(...) from builtins.PyCapsule
- go(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- make_specific_mutant(...) from builtins.PyCapsule
- make_specific_mutant(*args, **kwargs)
Overloaded function.
1. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant) -> NoneType
2. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant, mutation_string : str) -> NoneType
3. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant, mutation_string : str, mutation_string_PDB_numbering : str) -> NoneType
- mutants_begin(...) from builtins.PyCapsule
- mutants_begin(rosetta.protocols.pmut_scan.PointMutScanDriver) -> __gnu_cxx::__normal_iterator<protocols::pmut_scan::Mutant const*, std::vector<protocols::pmut_scan::Mutant, std::allocator<protocols::pmut_scan::Mutant> > >
- mutants_end(...) from builtins.PyCapsule
- mutants_end(rosetta.protocols.pmut_scan.PointMutScanDriver) -> __gnu_cxx::__normal_iterator<protocols::pmut_scan::Mutant const*, std::vector<protocols::pmut_scan::Mutant, std::allocator<protocols::pmut_scan::Mutant> > >
- n_mutants(...) from builtins.PyCapsule
- n_mutants(rosetta.protocols.pmut_scan.PointMutScanDriver) -> int
- read_in_structures(...) from builtins.PyCapsule
- read_in_structures(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- set_ddG_cutoff(...) from builtins.PyCapsule
- set_ddG_cutoff(self : rosetta.protocols.pmut_scan.PointMutScanDriver, threshold : float) -> NoneType
|
class PointMutScanDriver(builtins.object) |
| |
Methods defined here:
- __init__(...) from builtins.PyCapsule
- __init__(*args, **kwargs)
Overloaded function.
1. __init__(self : handle, pdb_file_names : rosetta.utility.vector1_std_string, double_mutant_scan : bool, list_file : str, output_mutant_structures : bool) -> NoneType
2. __init__(handle, rosetta.protocols.pmut_scan.PointMutScanDriver) -> 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.protocols.pmut_scan.PointMutScanDriver, : rosetta.protocols.pmut_scan.PointMutScanDriver) -> rosetta.protocols.pmut_scan.PointMutScanDriver
- calculate_neighbor_table(...) from builtins.PyCapsule
- calculate_neighbor_table(self : rosetta.protocols.pmut_scan.PointMutScanDriver, pose : rosetta.core.pose.Pose, neighbors : rosetta.utility.vector1_utility_vector1_bool_std_allocator_bool_t) -> NoneType
- fill_mutations_list(...) from builtins.PyCapsule
- fill_mutations_list(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- get_scorefxn(...) from builtins.PyCapsule
- get_scorefxn(rosetta.protocols.pmut_scan.PointMutScanDriver) -> rosetta.core.scoring.ScoreFunction
accessor for scorefxn_ now that it is private member data
- go(...) from builtins.PyCapsule
- go(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- make_specific_mutant(...) from builtins.PyCapsule
- make_specific_mutant(*args, **kwargs)
Overloaded function.
1. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant) -> NoneType
2. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant, mutation_string : str) -> NoneType
3. make_specific_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, mutant_poses : rosetta.utility.vector1_core_pose_Pose, native_poses : rosetta.utility.vector1_core_pose_Pose, m : protocols::pmut_scan::Mutant, mutation_string : str, mutation_string_PDB_numbering : str) -> NoneType
- mutants_begin(...) from builtins.PyCapsule
- mutants_begin(rosetta.protocols.pmut_scan.PointMutScanDriver) -> __gnu_cxx::__normal_iterator<protocols::pmut_scan::Mutant const*, std::vector<protocols::pmut_scan::Mutant, std::allocator<protocols::pmut_scan::Mutant> > >
- mutants_end(...) from builtins.PyCapsule
- mutants_end(rosetta.protocols.pmut_scan.PointMutScanDriver) -> __gnu_cxx::__normal_iterator<protocols::pmut_scan::Mutant const*, std::vector<protocols::pmut_scan::Mutant, std::allocator<protocols::pmut_scan::Mutant> > >
- n_mutants(...) from builtins.PyCapsule
- n_mutants(rosetta.protocols.pmut_scan.PointMutScanDriver) -> int
- read_in_structures(...) from builtins.PyCapsule
- read_in_structures(rosetta.protocols.pmut_scan.PointMutScanDriver) -> NoneType
- reject_mutant(...) from builtins.PyCapsule
- reject_mutant(self : rosetta.protocols.pmut_scan.PointMutScanDriver, : protocols::pmut_scan::Mutant, : rosetta.core.pose.Pose) -> bool
offers a chance for child classes to inject mutant selection logic
- score(...) from builtins.PyCapsule
- score(self : rosetta.protocols.pmut_scan.PointMutScanDriver, pose : rosetta.core.pose.Pose) -> float
score the pose for the purposes of determining if a mutation is "good" or not. In the base implementation, it's just a scorefunction call, but in child implementations it may be fancier (for example, calculating a binding energy instead)
- set_ddG_cutoff(...) from builtins.PyCapsule
- set_ddG_cutoff(self : rosetta.protocols.pmut_scan.PointMutScanDriver, threshold : float) -> NoneType
| |