Paramus
Cheminformatics MCP Distribution
This program is the core of the Paramus system. Its free. Download and install – ready to use with Claude Desktop, the openAI program, or Visual Code.
Features (by subject)
Cheminformatics
(CINF)
Free computational tools for molecules and reactions
- RDKit
- Chemfiles
Organic Chemistry
(ORGN)
Devise synthetic routes for chemical compounds
- Proposes pathways for molecule synthesis, evaluates feasibility
- Aligns synthesis plans with LLM’s strategic objectives
ASKCOS (available in AI Marketplace)
Computational & Physical Chemistry
(COMP, PHYS)
Quantum chemical calculations
- Runs molecular dynamics, quantum chemistry calculations, predicts kinetics and thermodynamics, calculate theoretical spectra
- PSI4, openMM, PySCF
Polymer Chemistry
(POLY)
(upcoming)
- Mie scattering
- Zeta potential
Material Science & Inorganic Chemistry
(INOR)
Materials discovery
- Property calculations
- Structure analysis
- Electronic property determination
- Solid-state thermodynamic stability assessment
Materials Project API Key needed
Statistics and Data Science
(DSML)
Random Forest, and SVM
DoE:
- General and 2-level Full-Factorial
- 2-level Fractional
- Plackett-Burman
- Generalized Subset
Response-Surface and Randomized:
- Box-Behnken
- Central-Composite
- Latin-Hypercube
Getting Started
- All PARAMUS software is delivered as local application (currently only PC).
- You find the Paramus MCP installer here.