Molecular Series Configuration

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Options

Molecule activity

Please select the molecule activity column.

Molecule structure

Select the column containing the molecular structures.

N. of molecules of large datasets

Set the number of molecules for considering a dataset as large. Large dataset will have fewer series determination methods activated (e.g. avoid molecule clustering).

Decimal places for activity representation (display only)

Please enter the number of decimals to which the activity should be displayed. Please note that this is for the purposes of the interactive views only. Full decimal precision is maintained in the underlying data.

Nodes

• String Manipulation (Variable)6 ×
• Rule Engine Variable4 ×
• CASE Switch End2 ×
• CASE Switch Start2 ×
• Column Selection Configuration2 ×
• Integer Configuration2 ×
• Single Selection Widget2 ×
• Column Splitter1 ×
• Component Input1 ×
• Component Output1 ×
• Constant Value Column1 ×
• Extract Table Dimension1 ×
• Inject Variables (Data)1 ×
• Merge Variables1 ×
• Text View1 ×

Extensions

• FeatureKNIME Base nodes
• FeatureKNIME Javasnippet
• FeatureKNIME Quick Forms
• FeatureKNIME Views

Links

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