Crater 发表于 2025-4-1 05:43:47

Structure Determination by NMR: The Modeling of NMR Parameters as Ensemble Averages,r assigning resonances to individual spins are being automated in various places. There is general agreement how NMR parameters like initial NOE build-up rates and J couplings must be translated into interatomic distances and dihedral angles. However, there is no consensus yet about the way such par

Lime石灰 发表于 2025-4-1 09:22:55

Time Averaged Distance Restraints in NMR Based Structural Refinement,her than regard the NOE as a measure of a static distance, we attempt to account for the fact that the measured quantity actually reflects a time averaged property of the molecule..A penalty function, suitable for incorporation into molecular dynamics simulations, is described which perturbs a syste

aphasia 发表于 2025-4-1 12:52:52

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CRP743 发表于 2025-4-1 16:11:38

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窗帘等 发表于 2025-4-1 20:02:18

lecules by Nuclear Magnetic Resonance Spectroscopy, which was held June 3-8, 1990 at Il Ciocco, near Barga, Italy. The use of computers in the study of biological macromolecules by NMR spectroscopy is ubiquitous. The applications are diverse, including data col­ lection, reduction, and analysis. Fur
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查看完整版本: Titlebook: Computational Aspects of the Study of Biological Macromolecules by Nuclear Magnetic Resonance Spectr; Jeffrey C. Hoch,Flemming M. Poulsen,