Remove (Node)

Remove molecules from a box
Context Generation
Name Required? No
Branches

Overview

The Remove node removes all molecules of one or more types of species from a configuration or, optionally, a selection of molecules as generated by one of the “pick”-style nodes.

Options

Target

Keyword Arguments Default Description
Selection name Specify the name of a picking node - the molecules picked by that node will be deleted.
Species name Target species to remove - all molecules of the given species will be deleted from the configuration. More than one species name may be given to the keyword if it is desired to remove multiple species.
Last modified October 30, 2024: feat: TR module added (#1956) (fe192b8)