Nuclear magnetic resonance is now routinely accessible to synthetic chemists. The generation of high quality NMR data including multidimensional experiments is no longer a rate-limiting step. Rather, the analysis of the data has become the primary hurdle for the chemist, as it has been for the skilled spectroscopist for many years. Both personal computer and web-based software tools are now available for the estimation and prediction of NMR spectra based on a structural input and the dream solution of automated structural elucidation based on spectral input is also becoming increasingly available. These tools offer to both the skilled and non-skilled NMR experimentalist much-needed assistance in data interpretation.

中文翻译：

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NMR预测和自动结构阐明软件的最新进展。

合成化学家现在通常可以进行核磁共振。包括多维实验在内的高质量NMR数据的生成不再是一个限速步骤。而是，对数据的分析已成为化学家的主要障碍，就像多年来对熟练的光谱学家一样。现在，基于结构输入的个人计算机和基于Web的软件工具都可用于NMR光谱的估计和预测，并且基于光谱输入的自动结构阐明的理想解决方案也越来越多。这些工具为熟练的和非熟练的NMR实验人员提供了数据解释方面急需的帮助。