New Features

New Features and Enhancements

• Forms View V1
• Create live web based forms to customize data views with widgets: multiple plots, tables, lists, and images
• Multiple form views per LiveReport

• Reaction based enumeration
• Schrödinger suite powered reaction based enumeration
• Use an included library of popular reactions, or sketch and save your own
• Reactants can be sketched in, loaded from SDF, or a LiveReport, bringing across vendor information to the output LiveReport

• Plotting improvements
• Export in PNG or SVG
• Manually adjust plot axes ranges

• Notification panel now tracks column and row addition/removal, with the option to undo these actions

• Usability improvements
• Rename SAR scaffolds
• Templates can be deleted by admins or template creators
• Hard refresh button to force data updates
• Rerun models as an entire column or individual cells, from within the LiveReport
• Freeform column picklist items can now be removed

• CoverPages can now provide customized project summaries

• Created limited assay columns based on experimental constraints to view specific experimental data side by side with full data

• LiveReport Metapicker improvements
• Created nested folders
• Bulk move or delete LiveReports
• Filter LiveReports only created by you

• Build and monitor QSAR models using AutoQSAR or DeepChem with a Machine Learning panel

• Admin features
• Access the admin panel from a LiveReport
• Quickly test a new model from within the model admin panel