Node Reference

Details on all available procedure nodes

Here you can find a list of all available node types for use in procedures.

Add (Node)

Insert molecules into a box

AddPair (Node)

Insert correlated molecule pair into a box

Box (Node)

Define / create a unit cell

CalculateAngle (Node)

Calculate angle between three sites

CalculateAxisAngle (Node)

Calculate angle between axes on two oriented sites

CalculateDistance (Node)

Calculate distance between two sites

CalculateVector (Node)

Calculate a vector between two sites

Collect1D (Node)

Accumulate a 1D histogram

Collect2D (Node)

Accumulate a 2D histogram

Collect3D (Node)

Accumulate a 3D histogram

CoordinateSets (Node)

Generate a population of molecules from a Species

DynamicSite (Node)

Generate a list of sites based on atom type or element

GeneralRegion (Node)

Constructs a general region

OperateDivide (Node)

Perform division on numerical data

OperateExpression (Node)

Perform division on numerical data

OperateMultiply (Node)

Perform division on numerical data

OperateNormalise (Node)

Perform division on numerical data

OperateNumberDensityNormalise (Node)

Normalise data to the number density of target site(s)

OperateSitePopulationNormalise (Node)

Normalise data to the populations of target site(s)

OperateSphericalShellNormalise (Node)

Normalise 1D data to spherical shell volumes

Parameters (Node)

Store numerical reference parameters

PickCylinder (Node)

Pick species molecules from a box

Pick (Node)

Pick species molecules from anywhere inside a box

Process1D (Node)

Process a 1D histogram

Process2D (Node)

Process a 2D histogram

Process3D (Node)

Process a 3D histogram

Remove (Node)

Remove molecules from a box

Select (Node)

Select a list of pre-defined sites on molecules

Last modified March 10, 2023: Web docs styling (#1350) (43924dc)