Multiscale theory for linear dynamic processes: Part 1. Foundations. - George Stephanopoulos; Orhan Karsligil; Matthew S. Dyer (Comput. Chem. Eng., 2008)

Multiscale theory for linear dynamic processes: Part 2. Multiscale model predictive control (MS-MPC). - George Stephanopoulos; Orhan Karsligil; Matthew S. Dyer (Comput. Chem. Eng., 2008)

Element selection for functional materials discovery by integrated machine learning of atomic contributions to properties. - Andrij Vasylenko; Dmytro Antypov; Vladimir V. Gusev; Michael W. Gaultois; Matthew S. Dyer; Matthew J. Rosseinsky (CoRR, 2022)

First Order Methods for Geometric Optimization of Crystal Structures. - Antonia Tsili; Matthew S. Dyer; Vladimir V. Gusev; Piotr Krysta; Rahul Savani (CoRR, 2023)

Optimality guarantees for crystal structure prediction. - Vladimir V. Gusev; Duncan Adamson; Argyrios Deligkas; Dmytro Antypov; Christopher M. Collins 003; Piotr Krysta; Igor Potapov; George R. Darling; Matthew S. Dyer; Paul G. Spirakis; Matthew J. Rosseinsky (Nat., 2023)

The Theory of Probabilistic Hierarchical Supervised Ensemble Learning. - Ziauddin Ursani; Dmytro Antypov; Katie Atkinson; Judith Clymo; Matthew S. Dyer; Matthew J. Rosseinsky; Sven Schewe; Andrij Vasylenko (ICMLA, 2024)

Hierarchical Supervised Monte Carlo Ensemble Learning. - Ziauddin Ursani; Dmytro Antypov; Katie Atkinson; Judith Clymo; Matthew S. Dyer; Matthew J. Rosseinsky; Sven Schewe; Andrij Vasylenko (ICMLA, 2024)

Assessing data-driven predictions of band gap and electrical conductivity for transparent conducting materials. - Federico Ottomano; John Yannis Goulermas; Vladimir Gusev; Rahul Savani; Michael W. Gaultois; Troy D. Manning; Hai Lin; Teresa P. Manzanera; Emmeline G. Poole; Matthew S. Dyer; John B. Claridge; Jon Alaria; et al. (CoRR, 2024)

MACS: Multi-Agent Reinforcement Learning for Optimization of Crystal Structures. - Elena Zamaraeva; Christopher M. Collins 003; George R. Darling; Matthew S. Dyer; Bei Peng; Rahul Savani; Dmytro Antypov; Vladimir V. Gusev; Judith Clymo; Paul G. Spirakis; Matthew J. Rosseinsky (CoRR, 2025)