Uses of Interface
ffx.xray.DataContainer
Packages that use DataContainer
Package
Description
The Real Space package implements real space structure refinement.
The X-ray package implements support for X-ray and Neutron refinement.
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Uses of DataContainer in ffx.realspace
Classes in ffx.realspace that implement DataContainer -
Uses of DataContainer in ffx.xray
Classes in ffx.xray that implement DataContainerConstructors in ffx.xray with parameters of type DataContainerModifierConstructorDescriptionRefinementEnergy(DataContainer dataContainer) Constructs a RefinementEnergy instance with the input data and optimization scaling factors.RefinementMinimize(DataContainer dataContainer) Constructor for the RefinementMinimize class, which initializes the refinement process with a specified data container and no algorithm listener.RefinementMinimize(DataContainer dataContainer, AlgorithmListener algorithmListener) Constructor for the RefinementMinimize class, initializing the refinement process with a specified data container and an optional algorithm listener for updates.