Multiobjective genetic algorithms for multiscaling excited state direct dynamics in photochemistry. - Kumara Sastry; D. D. Johnson; Alexis L. Thompson; David E. Goldberg; Todd J. Martínez; Jeff Leiding; Jane Owens (GECCO, 2006)

Graphical Processing Units for Quantum Chemistry. - Ivan S. Ufimtsev; Todd J. Martínez (Comput. Sci. Eng., 2008)

Implementation of scientific computing applications on the Cell Broadband Engine. - Guochun Shi; Volodymyr V. Kindratenko; Ivan S. Ufimtsev; Todd J. Martínez; James C. Phillips; Steven A. Gottlieb (Sci. Program., 2009)

Direct self-consistent field computations on GPU clusters. - Guochun Shi; Volodymyr V. Kindratenko; Ivan S. Ufimtsev; Todd J. Martínez (IPDPS, 2010)

High-Performance Computing with Accelerators. - Volodymyr V. Kindratenko; Robert B. Wilhelmson; Robert J. Brunner; Todd J. Martínez; Wen-mei W. Hwu (Comput. Sci. Eng., 2010)

A program for automatically predicting supramolecular aggregates and its application to urea and porphin. - Torsten Sachse; Todd J. Martínez; Benjamin Dietzek; Martin Presselt (J. Comput. Chem., 2018)

TeraChem Cloud: A High-Performance Computing Service for Scalable Distributed GPU-Accelerated Electronic Structure Calculations. - Stefan Seritan; Keiran Thompson; Todd J. Martínez (J. Chem. Inf. Model., 2020)

Voice-controlled quantum chemistry. - Umberto Raucci; Alessio Valentini; Elisa Pieri; Hayley Weir; Stefan Seritan; Todd J. Martínez (Nat. Comput. Sci., 2021)