| Package | Description |
|---|---|
| de.bioforscher.singa.structure.algorithms.superimposition.fit3d |
| Modifier and Type | Class and Description |
|---|---|
static class |
Fit3DBuilder.Builder |
| Modifier and Type | Method and Description |
|---|---|
Fit3DBuilder.ParameterStep |
Fit3DBuilder.AtomStep.atomFilter(Predicate<Atom> atomFilter)
Defines a
StructuralEntityFilter.AtomFilter filter to be used for the Fit3D alignment (e.g. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.atomFilter(Predicate<Atom> atomFilter) |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.distanceTolerance(double distanceTolerance)
Defines the distance tolerance that is accepted when extracting local environments.
|
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.distanceTolerance(double distanceTolerance) |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.filterEnvironments()
Enables pre-filtering of extracted environments, i.e.
|
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.filterEnvironments() |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.mapECNumbers()
Enables mapping of each chain of a
Fit3DMatch to an ECNumber using the SIFTS project. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.mapECNumbers() |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.mapPfamIdentifiers()
Enables mapping of each chain of a
Fit3DMatch to a PfamIdentifier using the SIFTS project. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.mapPfamIdentifiers() |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.mapUniProtIdentifiers()
Enables mapping of each chain of a
Fit3DMatch to a UniProtIdentifier using the SIFTS project. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.mapUniProtIdentifiers() |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.AtomStep.representationScheme(RepresentationSchemeType representationSchemeType)
Defines a single point
RepresentationScheme that should be used to represent single residues. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.representationScheme(RepresentationSchemeType representationSchemeType) |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.rmsdCutoff(double rmsdCutoff)
Defines the RMSD cutoff up to which matches should be reported.
|
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.rmsdCutoff(double rmsdCutoff) |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.ParameterStep.statisticalModel(StatisticalModel statisticalModel)
Adds the specified
StatisticalModel to the search to calculate significance of matches. |
Fit3DBuilder.ParameterStep |
Fit3DBuilder.Builder.statisticalModel(StatisticalModel statisticalModel) |
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