We describe and implement a computer-assisted approach for accelerating the exploration of uncharted effective free-energy surfaces (FESs). More generally, the aim is the extraction …
Enforcing sparse structure within learning has led to significant advances in the field of data- driven discovery of dynamical systems. However, such methods require access not only to …
V Boyko, N Vercauteren - Quarterly Journal of the Royal …, 2023 - Wiley Online Library
The atmospheric boundary layer is particularly challenging to model in conditions of stable stratification, which can be associated with intermittent or unsteady turbulence. We develop …
Complex dynamical systems are notoriously difficult to model because some degrees of freedom (eg, small scales) may be computationally unresolvable or are incompletely …
Although the governing equations of many systems, when derived from first principles, may be viewed as known, it is often too expensive to numerically simulate all the interactions they …
Understanding the impact of model error on data assimilation is an important practical topic. Model error in the subgrid scale is commonly seen in various applications as a natural …
A Moradzadeh, NR Aluru - The journal of physical chemistry letters, 2019 - ACS Publications
Machine learning is an attractive paradigm to circumvent difficulties associated with the development and optimization of force-field parameters. In this study, a deep neural network …
The application of stochastic differential equations (SDEs) to the analysis of temporal data has attracted increasing attention, due to their ability to describe complex dynamics with …
We study the problem of drift estimation for two-scale continuous time series. We set ourselves in the framework of overdamped Langevin equations, for which a single-scale …