Paul Saxe
Lead Software Scientist
Ph.D., U.C. Berkeley
Forcefields, Quantum chemistry, DFT, Biomolecular Simulations, Polymers, Materials
Andrew Abi-Mansour
Ph.D., Indiana University
Nanoscience, Materials Engineering, Multiscale Simulations
Taylor Barnes
Ph.D., California Institute of Technology
Parallelization, Optimization, Embedding, Batteries
Jing Chen
Ph.D., California Institute of Technology
Parallelization, Optimization, Embedding, Batteries
Sam Ellis
Ph.D., Iowa State University
Software Engineering, Molecular Programming
Susi Lehtola
Ph.D., U. of Helsinki
Density Functional Theory, Coupled Cluster Theory, Fully Numerical Methods, Localized Orbitals
Sina Mostafanejad
Ph.D., Florida State University
Electronic Structure Theory, Optimization, HPC, C/C++
Jonathan Moussa
Ph.D., U.C., Berkeley
Computational Physics, Numerical Analysis, Quantum Information Theory
Levi Naden
Ph.D., U. Virginia
Biomolecular Simulation, Workflows, Reproducibility
Jessica Nash
Ph.D., N.C. State University
Molecular Dynamics Simulations, All-Atom Simulations, Nucleic Acids, DNA Nanotechnology, Nanomaterials
Benjamin Pritchard
Ph.D., University at Buffalo
C++, Software interoperability, Code optimization, High-precision computation
Former Software Scientists
Doaa Altarawy
(2017 to 2021)
Ph.D., Virginia Tech
Computer Science, Machine Learning, Algorithms, Software Engineering, Visualization, Computational Biology
Eliseo Marin-Rimoldi
(2018 to 2021)
Ph.D., U. Notre Dame
Monte Carlo, Molecular Simulation, Statistical Mechanics, Advanced Sampling Techniques
Daniel G.A. Smith
(2016 to 2020)
Ph.D., MIT
Quantum embedding, machine learning
Matthew Welborn
(2019 to 2020)
Ph.D., MIT
Quantum embedding, machine learning
