Prof. Dr. Andrey Ustyuzhanin

Chief Science Officer, Adjunct Professor of Computer Science

Prof. Dr. Andrey Ustyuzhanin is the Director of AI Research at Constructor Knowledge, a Visiting Research Professor at the National University of Singapore (I-FIM), and an Adjunct Professor of Computer Science at Constructor University Bremen. With over two decades of research experience, he applies AI to accelerate scientific discovery across particle physics, materials science, and cybersecurity.

Awards: 2025 Breakthrough Prize in Fundamental Physics (LHCb Collaboration at CERN). h-index 145, 85K+ citations. PhD in Computer Science from the Institute of System Programming, Russian Academy of Sciences (2007).

AI for particle physics: Leads the Constructor University team in the SHiP experiment at CERN—developing AI-powered co-design for next-generation subdetectors. Previously led Yandex School of Data Analysis group at LHCb. Contributed to discoveries of tetraquarks, pentaquarks, and precision matter–antimatter asymmetry measurements.

AI for materials science: Develops generative models, interpretable ML, and multiscale simulation methods for catalysis, quantum materials, and memristors. Co-authored comprehensive reviews on AI for solid-state physics (with K. Novoselov).

Agentic AI for research: Pioneering the use of multi-agent pipelines and structured knowledge management to automate hypothesis generation, experimental design, and scientific literature analysis.

Research Portfolio

Prof. Ustyuzhanin’s core expertise lies in developing machine-learning methods that accelerate scientific discovery, which maps directly onto the Autonomous Science and AI Applications directions at Constructor Labs. For over two decades he has built AI systems that formulate and test hypotheses under the demanding constraints of real experimental science — from high-energy physics at CERN (the LHCb and SHiP experiments) to materials design, catalysis, quantum materials, and antibiotics discovery. This work spans the full autonomous-science loop: generative models that propose candidate structures, differentiable and surrogate-based optimization of experiments and detectors, anomaly detection for new-physics searches, and reproducible ML pipelines that make results auditable across large collaborations. These directions are backed by concrete outcomes rather than method work alone: as a member of the LHCb Collaboration he shares in the 2025 Breakthrough Prize in Fundamental Physics, his group’s methods have been adopted in experimental-physics workflows and open-source tooling, and he continues to lead international, cross-disciplinary collaborations — including current work as a Visiting Research Professor at the National University of Singapore (I-FIM) and as coordinator of the Materials Science Working Group in the EU Horizon Europe project SCIANCE (Strategic Coordination of AI-enabled Science in Europe).

His relevance to the EdTech direction is direct and long-standing. As Director of AI Research at Constructor Knowledge, his work targets Personalized Knowledge Transmission and Human–AI Co-Cognition / TeachingAI — systems that turn expert knowledge into adaptive learning artifacts and interfaces where AI agents can explain their reasoning and discoveries to learners. This builds on years of designing and teaching graduate ML curricula, founding and running research-education labs, and mentoring students who now work across academia and industry. He approaches education the same way he approaches science: as a problem of transmitting complex, evolving knowledge efficiently and verifiably to a human on the other side.

What ties these threads together — and what he brings to Constructor Labs specifically — is the conviction that autonomous science and personalized education are two sides of the same challenge: building AI that reasons about a domain well enough to both advance it and teach it. His contributions aim to make that loop concrete, so that the same systems which help discover new physics or materials can also explain those discoveries to the next generation of students and researchers.

Autonomous Science

Investigates end-to-end AI systems capable of conducting scientific work with progressively decreasing human supervision – from literature synthesis and hypothesis generation to experiment design, execution, and writing. The direction subsumes two foundational sub-layers: (a) machine-actionable representations of the scientific body of knowledge – temporal hypergraphs, applicability constraints, formalism-based clustering – that give agents a substrate for structural reasoning beyond context windows; and (b) competence-aware models of human and machine expertise (cognitive twins, competence hypergraphs) enabling autonomous agents to locate, combine, and complement capabilities across a research ecosystem.

Personalized Knowledge Transmission and Adaptive Education

Explores how rationale-aware AI systems can transform expert knowledge into highly personalized educational artifacts – courses, lectures, explanations – tailored to learner profiles and pedagogical goals. Targets the full pipeline from source material to learner: extracting the latent semantic and didactic flow of a domain, encoding instructor intent and meta-cognitive scaffolding, and generating adaptive content that compresses revision cycles from weeks to days across math, programming, and the sciences.

Human–AI Co-Cognition and TeachingAI 

Studies the interface layer where autonomous scientific agents meet human researchers, instructors, and students – through navigable cognitive maps, spatial knowledge landscapes, and avatar-mediated dialogue. A central motif is TeachingAI: as autonomous science advances faster than humans can follow, AI systems must explain their own results – reconstructing the rationale, surfacing prerequisites, and adapting the depth of explanation to the listener – so that the gap between machine-generated discovery and human comprehension does not widen indefinitely. The direction investigates dual-view representations (coarse-grained human exploration + fine-grained agent retrieval as projections of one substrate), shared cognitive maps for collaborative reasoning, and protocols for trust, attribution, and intent transfer between humans and their AI co-workers and AI tutors.

Publications on ResearchGate


Publications on Scopus

FastTrack SSB: AI Screening for Next-Gen Electrolytes

Accelerating Advanced Device Design with Generative Optimization

Next-Gen Material Discovery with Mirage Atom Diffusion  

From Task to Code: Automating ML Pipeline Generation with Linguacodus

AI-Scientist (MIND-MATTER)

Semantic Flow AI

Knowledge Discovery

CERN Detector Optimization (Co-design)

AI Antibiotics (Gram-negative AMR)

Systematics Audit (DL advocatus)

MiAD Crystal Generation (Mirage Atoms)

Quantum Spin Chain ML (SDRG-GNN)