Partner with MQS to apply advanced quantum chemistry and machine learning tools to your R&D challenges. We bridge the gap between computational simulation and experimental validation.
Start a conversationIntegrate our quantum chemistry and ML pipelines into your existing workflows with costumizable, modular components.
Access our team of experts at the intersection of quantum chemistry, machine learning, chemical engineering and lab automation.
From pharmaceuticals to materials science, our platform adapts to diverse molecular and structural challenges.
Reduce time-to-discovery with high-performance computing and predictive simulations that minimize laboratory experiments via closed-loop design of experiments.
We offer multiple enagement models tailored to your organization's needs, from technology licensing to fully embedded joint R&D programs.
Collaborate with our scientists to co-develop solutions for your specific R&D challenges. We work alongside your team to accelerate your research pipeline via the Cebule™ platform.
Molecular search across 200M+ compounds and novel structure generation for high-throughput screening
Thermodynamic property data analysis, comparison and ranking
Apply quantum chemistry based data for ML/AI training
AI Research Agent for guided discovery
License the Cebule™ platform for internal use within your organization for a specific co-developed use-case. Deploy on your infrastructure with full integration support of your toolstack.
Python SDK with full access to quantum chemistry, molecular tailored AI/ML library and quantum computing methods
JupyterLab and Kubeflow integration capabilities
SLURM and hybrid cloud infrastructure
Closed-loop design of experiments lab connection
We actively collaborate with universities and research institutions on fundamental and applied research in quantum chemistry and quantum computing.
Joint research projects via research grants
Academic licensing of Cebule and support
Digital transformation projects
Integration of free licensed and open-source datasets and packages
Engage our experts for targeted consulting projects, feasibility studies, or specialized computational services.
Cebule pay-per-usage model with support
AI research agent for quick on-boarding and prototype setups
Guided expert help from MQS
Digital transformation analysis for best setup
Our platform and expertise apply across multiple compound classes and chemical engineering applications where molecular understanding drives innovation.
Formulation Design
Manufacturing / Process Design
Quantum Chemistry + AI/ML + Quantum Computing Pipelines
Automated Lab
Small Drug Molecules
Peptides
Ionic Liquids
(Bio)Polymers, Catalysts
