Run quantum chemistry simulations through natural language

Transform complex computational chemistry workflows into simple conversations. Execute DFT calculations, molecular dynamics, and quantum simulations using plain English.

Lexon Chemistry Engine
Water (H₂O)
Discover features

Accelerate research

With Lexon embedded throughout your workflow, you can simplify complex calculations, automate quantum simulations, and improve the research experience.

Lexon Chemistry Engine
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AI
Hello! I'm ready to help with your quantum chemistry calculations. What would you like to explore?
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Reduce calculation time by 75%

Increase research productivity with AI-powered quantum chemistry assistance, including automated method selection, basis set optimization, and result interpretation.

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ChemTech Labs reduced computational overhead by 60% with Lexon's natural language interface.

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Molecular Dynamics Inc

2024 Leader in "Computational Chemistry Platforms" for AI-Powered Research Acceleration

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Work together, achieve more

Collaborate with your research teams, use management tools that sync with your calculations, and monitor progress from anywhere—all on a single, integrated platform.

Last 24 hours

Running Calculations

8 active
DFT Optimization - Aspirin
DR
Dr. Rodriguez
67%
MD Simulation - Protein Folding
JC
Prof. Chen
23%
HOMO-LUMO Gap - Benzene
AS
A. Smith
Done

Computational Load

2.4k CPU hours
00:00 06:00 12:00 18:00 24:00

Team Activity

12 researchers
DR
Dr. Rodriguez completed DFT calculation 2 min ago
JC
Prof. Chen started MD simulation 15 min ago
AS
A. Smith shared results with team 1 hour ago

Your research, your way.

Monitor progress effectively with an adaptable dashboard that syncs with your computational workflows.

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"Lexon helps us coordinate complex quantum chemistry projects and get our team working efficiently. We have all our calculations, results, and collaboration in one place... Lexon is a complete research platform that frees us from administrative overhead and enables us to focus on discovery."
Dr. Sarah Mitchell
Principal Investigator at Quantum Research Labs

Automate any calculation

Optimize your research process from simple queries to end-to-end secured computational workflows.

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Get up and running in seconds

Start quantum calculations instantly with natural language commands.

Optimize on the fly

Real-time geometry optimization and method selection for best results.

🔗

Integrate the tools you love

Connect with Gaussian, ORCA, VASP, and other computational chemistry software.

Quick Start - DFT Workflow
Molecule Input Draw, upload SMILES, or describe structure
30s
Method Selection AI recommends optimal basis set and functional
15s
Calculation Launch Automated job submission and monitoring
5s
Results Analysis Automated visualization and interpretation
Auto
Real-time Optimization

Geometry Optimization Progress

Cycle 12/50
Energy: -154.3247 Hartree Convergence: 0.0001
Software Integration
Gaussian 16 Connected
ORCA 5.0 Connected
VASP Connected
Q-Chem Available

From simple questions to complex calculations

Experience the power of natural language quantum chemistry. Watch real commands in action.

Lexon Chemistry Terminal
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lexon@chemistry:~$

Natural Language Processing

Ask questions in plain English and get expert quantum chemistry guidance.

Instant Execution

Complex calculations launch automatically with optimized parameters.

Expert Knowledge

Built-in understanding of quantum chemistry methods, basis sets, and best practices.

Natural conversations, powerful results

Experience the intuitive chat interface where complex quantum chemistry becomes as simple as asking a question.

Lexon - Quantum Chemistry Assistant
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AI
Hello! I'm Lexon, your quantum chemistry assistant. I can help you with calculations, visualizations, and explanations. What would you like to explore today?
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Conversational Interface

Ask questions naturally and get expert explanations in plain English.

Interactive Visualizations

See molecular structures, orbitals, and reaction pathways in 3D.

Real-time Results

Get instant calculations and live progress updates as jobs run.

Computational Chemistry Made Simple

Advanced quantum chemistry tools accessible through natural language

DFT Calculations

Run density functional theory calculations using simple natural language commands. No complex input files required.

Molecular Dynamics

Simulate molecular behavior over time with advanced MD algorithms. Visualize trajectories and analyze results.

Quantum Simulations

Execute complex quantum mechanical calculations with state-of-the-art algorithms and basis sets.

Property Prediction

Predict molecular properties, reaction energies, and spectroscopic data using machine learning models.

Secure Computing

Enterprise-grade security for sensitive research data with encrypted communications and secure cloud computing.

Research Integration

Export results to popular formats, integrate with existing workflows, and collaborate with research teams.

How It Works

From natural language to quantum results in three steps

1

Describe Your System

Simply describe your molecule or chemical system in plain English. "Optimize the geometry of caffeine" or "Calculate the HOMO-LUMO gap of benzene".

2

AI Translates to Code

Lexon automatically generates the appropriate quantum chemistry input files, selects optimal methods, and configures computational parameters.

3

Get Results & Insights

Receive publication-ready results with visualizations, analysis, and natural language explanations of your computational chemistry data.

Ready to Revolutionize Your Research?

Join leading researchers who are accelerating discovery with natural language quantum chemistry.

Start Your First Simulation