About Q-SAGE

Pioneering the Next Era of Molecular Design.

Our mission is to redefine the boundaries of modern drug discovery. By synergizing the rigorous accuracy of Quantum Chemistry with the scalable efficiency of Machine Learning, we develop next-generation computational platforms, including AVENGERS and SAGE. Moving beyond conventional screening, these advanced tools proactively design and validate novel therapeutics, unlocking chemical spaces that were previously inaccessible.

Bridging Quantum Precision and AI Innovation.

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  • Research Areas

    Generative Chemistry and Biology

    Computer-Aided Drug and Protein Design

    Generative AI and Machine Learning

    Quantum Chemistry and Molecular Simulation

    Quantum Computing for Quantum Chemistry and Machine Learning

    Research Interests

    I'll lay the CARPET for you to reach your goals with my AVENGERS.

    Virtual Screening

    Molecular Design

    Rapidly identifies potential hit molecules from ultra-large chemical libraries or via advanced de novo generation.

    Lead Optimization

    Molecular Design

    Refines hit molecules through precise quantitative structure-activity relationship (QSAR) analysis to maximize target efficacy.

    ADME/T Prediction

    Molecular Design

    Accurately forecasts ADME/T properties and proposes optimized derivatives with enhanced safety and drug-likeness.

    Virtual Screening

    Protein Design

    Screens extensive mutant libraries to discover variants with superior binding affinity, selectivity, and enzymatic activity.

    Protein Optimization

    Protein Design

    Enhances protein function and thermal stability by leveraging machine learning and 3D structural molecular modeling.

    Property Prediction

    Protein Design

    Predicts critical biophysical properties, such as immunogenicity, aggregation propensity, and cleavage sites, to ensure viable biotherapeutic development.

    Professional Experience

    Educational Background

    Award and Honors