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- W4211106736 abstract "A hybrid experimental-computational method to determine conformational equilibria and dynamics of biomolecules in solution has been developed that employs redundant nuclear magnetic resonance (NMR) spin-spin coupling constants (J-couplings), density functional theory (DFT) and circular statistics. The method has been encoded into a simple, user-friendly web-based application. The mathematics that underpins the method, known as MA’AT analysis, will be presented, and key components of a computer program that incorporates this algorithm will be discussed." @default.
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- W4211106736 date "2022-02-01" @default.
- W4211106736 modified "2023-09-27" @default.
- W4211106736 title "MA’AT: a web-based application to calculate rotamer population distributions from NMR spin-coupling constants" @default.
- W4211106736 doi "https://doi.org/10.1016/j.bpj.2021.11.2796" @default.
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