Molecule-to-MAE

Options

Column containing structure

Column in the input data table containing the structure to be converted.

Include Input

Includes all input columns in the output

Parameter flow variables

Any valid option for this node can be specified through flow variables. Only String variables are accepted.
Usage:
Flow variable prefix keyword: MoleculeToMae
Note: To specify an option as flow variable, the flow variable name should be like:
keyword-option_name for single-dash option
keyword--option_name for double-dash option

To add a new option with value, specify the option_name and the corresponding value through the flow variable.

To add a new option without a value, specify the option_name and the value as _on_ through the flow variable.

To override an existing option's value, specify the option_name and the new value through the flow variable.

To remove an existing option without a value, specify the option_name and the value as _off_ through the flow variable.

To remove an existing option with a value, specify the option_name and the value as _rm_ through the flow variable.

Note: This node adds a new flow variable 'backend' so that downstream node can access the backend used by this node.

Views

Std output/error of Molecule2MAE

Std output/error of Molecule2MAE

Workflows

• 02_Run Maestro, Run Maestro commandKNIME Hub
• 02_Run Maestro, Run Maestro commandKNIME Hub
• 05_Multiple Sequence ViewerKNIME Hub
• 05_Multiple Sequence ViewerKNIME Hub
• Add structures as Generic EntityKNIME Hub
• Show all 68 workflows

Links

• No links available

Developers