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20232026
most citedGPT-4 as an interface between researchers and computational software: improving usability and reproducibility

2 citations · 2 across the 9 of their papers we have counts for

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physics.chem-ph2026

A Data-Driven Parametric Reduced-Order Chemical Kinetics Model Derived from Atomistic Simulations

Michael N. Sakano, Alejandro Strachan

Coarse-grained modeling in molecular simulations serves not only to extend accessible time and length scales beyond atomistic limits, but also to reduce high-dimensional chemical d…

physics.chem-ph2026

Nuclear Quantum Effects in Multi-Step Condensed Matter Chemistry: A Path Integral Molecular Dynamics Study of Thermal Decomposition

Jalen Macatangay, Alejandro Strachan

Nuclear quantum effects (NQEs) are often central to a predictive understanding of chemical reactions and rates. While their incorporation in gas-phase reactions is well established…