Wolfram Paclet Repository

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The Wolfram|Alpha Chemistry Team
Instant-use add-on chemistry paclets for the Wolfram Language.
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Name
Description
RobertNachbar/CompartmentalModeling
Build, visualize, analyze, and simulate compartmental models
RobertNachbar/ConsistentForceField
Ermer-Lifson CFF for alkanes, alkenes, and alkylbenzenes
RobertNachbar/MoleculeComplex
Functions for creating and working with MoleculeComplex's, which are collections of Molecule objects in the same 3D space
RohanMehta/OpenChemicalSystems
Model, stochastically simulate, and visualize arbitrary open chemical systems using a Petri Net framework
StianRamsnes/MaXrd
Symmetry data and utilities related to crystallography and X-ray scattering
WolframChemistry/ChemistryFunctions
Wolfram Language functions for Chemistry
WolframChemistry/IsomerGeneration
Generate Isomers from Chemical Formulas
WolframChemistry/MoleculeFingerprints
Compute and compare molecule fingerprints
WolframChemistry/ProteinVisualization
Functions for protein visualizations
WolframChemistry/Selfies
SELF-referencIng Embedded Strings
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Last updated: 5/23/25