Uses of Package
ffx.xray.commands
Packages that use ffx.xray.commands
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Classes in ffx.xray.commands used by ffx.xray.commandsClassDescriptionThe X-ray Annealing script.Use AverageMTZ to provide two MTZ files and an iteration for a cumulative moving average.The CIF2MTZ script saves a CIF file to MTZ format.The X-ray ComputeFc script.Deuterate changes exchangeable hydrogen atoms to deuterium atoms for a PDB file.The X-ray Dynamics script.The GenZ script for calculating free energy changes.The ManyBody script performs a discrete optimization using a many-body expansion and elimination expressions.The X-ray Minimize script.The X-ray ModelvsData script.The MTZInfo script prints out MTZ reflection file header info.The SaveConformerPDB script saves alternate conformers with proper alt loc labels.The X-ray Timer script.