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most citedSESNet: sequence-structure feature-integrated deep learning method for data-efficient protein engineering

39 citations · 108 across the 10 of their papers we have counts for

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physics.comp-ph2021★ 26 cited

A random batch Ewald method for charged particles in the isothermal-isobaric ensemble

Jiuyang Liang, Pan Tan, Liang Hong +3

We develop an accurate, highly efficient and scalable random batch Ewald (RBE) method to conduct simulations in the isothermal-isobaric ensemble (the NPT ensemble) for charged part…

physics.comp-ph2021★ 35 cited

Superscalability of the random batch Ewald method

Jiuyang Liang, Pan Tan, Yue Zhao +4

Coulomb interaction, following an inverse-square force-law, quantifies the amount of force between two stationary and electrically charged particles. The long-range nature of Coulo…