Uses of Class
ffx.realspace.parsers.RealSpaceFile
Package
Description
The Real Space package implements real space structure refinement.
The Real Space CLI package defines options for PicoCLI command line scripts.
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Uses of RealSpaceFile in ffx.realspace
ModifierConstructorDescriptionRealSpaceData
(MolecularAssembly[] molecularAssemblies, org.apache.commons.configuration2.CompositeConfiguration properties, ParallelTeam parallelTeam, RealSpaceFile... dataFile) Construct a real space data molecularAssemblies.RealSpaceData
(MolecularAssembly assembly, org.apache.commons.configuration2.CompositeConfiguration properties, ParallelTeam parallelTeam, RealSpaceFile... datafile) Construct a real space data molecularAssemblies. -
Uses of RealSpaceFile in ffx.realspace.cli
Modifier and TypeMethodDescriptionRealSpaceOptions.processData
(List<String> filenames, MolecularAssembly molecularAssembly) Process input to collect Real Space Files.