Hist Arch (2023) 57:126–153 https://doi.org/10.1007/s41636-023-00394-3 ORIGINAL ARTICLE Wrecked All Over the Place: The Identification of Disarticulated Context‑Free Ship Remains from the Gold Coast in Queensland, Australia Wendy van Duivenvoorde · Lauren Davison...
In addition to the above observations, in some exceptional cases the ΔΔGelcalculated with different force fields differed by more than 100 kcal/mol. Particular example is tail-associated lysozyme bound to baseplate structural protein GP27 (PDB ID 1k28) for which ΔΔGelcalculated with Charmm27,...
Submission received: 23 November 2022/Revised: 21 December 2022/Accepted: 22 December 2022/Published: 2 February 2023 (This article belongs to the Special IssueAdvances in Computer Assisted Structure Elucidation (CASE)) Downloadkeyboard_arrow_down ...
Structure elucidation from 2D NMR spectra using the StrucEluc expert system: Detection and removal of contradictions in the data. J. Chem. Inf. Comput. Sci. 2004, 44, 1737–1751. [Google Scholar] [CrossRef] Hubert, J.; Nuzillard, J.-M.; Renault, J.-H. Dereplication strategies in ...