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- W3210071685 abstract "Computational prediction of the pKa of ionizable groups remains a central challenge in biomolecular modeling. Although all-atom fixed-charge force fields could be accurate to describe the interacti..." @default.
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- W3210071685 date "2020-09-02" @default.
- W3210071685 modified "2023-09-26" @default.
- W3210071685 title "Titration of Adenine in a GA mismatch with Grand Canonical Simulations" @default.
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- W3210071685 doi "https://doi.org/10.1142/s0219633620420055" @default.
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