86 citations · 86 across the 1 of their papers we have counts for
2 papers
physics.chem-ph2016★ 86 cited
Exploring High Dimensional Free Energy Landscapes: Temperature Accelerated Sliced Sampling
Shalini Awasthi, Nisanth N. Nair
Biased sampling of collective variables is widely used to accelerate rare events in molecular simulations and to explore free energy surfaces. However, computational efficiency of…
physics.comp-ph2015
Sampling Free Energy Surfaces as Slices by Combining Umbrella Sampling and Metadynamics
Shalini Awasthi, Venkat Kapil, Nisanth N. Nair
Metadynamics (MTD) is a very powerful technique to sample high-dimensional free energy landscapes, and due to its self-guiding property, the method has been successful in studying…