Example Programs: ENUMERATE

What it does:

Uses transform objects to generate combinatorial mixtures of molecules.

• As input takes sets of molecules and generic reactions.
• Applies the generic reactions to the sets of molecules combinatorially to generate specific reactions.
• Extracts and keeps the sets of molecules generated.
• Outputs a unique set of molecules generated.

What it illustrates:

• Use of transform objects.

• Suggests a representation for mixtures.