157 citations · 291 across the 6 of their papers we have counts for
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cond-mat.mes-hall2024★ 7 cited
pyMSER -- An open-source library for automatic equilibration detection in molecular simulations
Felipe Lopes Oliveira, Binquan Luan, Pierre Mothé Esteves +2
Automated molecular simulations are used extensively for predicting material properties. Typically, these simulations exhibit two regimes: a dynamic equilibration part, followed by…
cond-mat.mes-hall2020★ 16 cited
Nanopores in atomically thin 2D nanosheets limit aqueous ssDNA transport
Alex Smolyanitsky, Binquan Luan
Nanopores in 2D materials are highly desirable for DNA sequencing, yet achieving single-stranded DNA (ssDNA) transport through them is challenging. Using density functional theory…