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Computational Data Science Researcher

Shell Technology Centre - Bangalore💼 Full-time🗓 2026-07-06 → 2026-07-31

Core

Develop and deploy advanced statistical, chemometric, and physics-informed AI models to convert complex chemical and process data into actionable insights for operational excellence and innovation in energy systems.

Role type

Senior individual contributor computational chemometrician and data science researcher

Builds

Scalable digital workflows for process monitoring, optimization, quality control, and R&D in Integrated Gas, Downstream, and Renewables & Energy Solutions

Domain

Energy sector (LNG, GTL, Renewables) + Chemometrics + Physics-informed Machine Learning

Deliverable

production ML models

Required skills

Chemometrics, Bayesian statistical learning, Physics- and chemistry-informed machine learning, Spectral and chromatographic modeling, Uncertainty quantification, Deterministic and stochastic optimization, Analytical chemistry techniques (chromatography, spectroscopy), Multivariate analysis, Time series analysis

Preferred skills

Reinforcement learning, GANs, Meta-learning, Active learning, Generative AI, Deep learning for spectroscopy, Manifold learning, Cloud-based scientific computing workflows

Technologies

Bayesian statistical learning frameworks, Spectral modeling tools, Chromatographic data analysis platforms, Cloud-based scientific computing environments

Responsibilities

Design and implement advanced chemometric and hybrid modeling frameworks; Define methodological strategy balancing interpretability and predictive performance; Collaborate with chemists and engineers to translate physicochemical behavior into computational solutions; Develop robust models for noisy, sparse datasets in real-time environments; Ensure model credibility through rigorous validation against experimental and operational data; Apply methods to identify variability drivers and support process optimization; Drive innovation in AI-enabled data analysis and contribute to scientific leadership via publications.

Seniority

Senior, hands-on IC with research leadership

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