Computational research that merely reproduces experimental data is not suitable for OBC. Relevance is perhaps most clearly demonstrated by the description of testable predictions derived from the results of the reported theoretical work the tests of these predictions could be contained in the same paper in which the predictions are described. That relevance should be clearly justified in the paper. We welcome studies that report new models of reactivity, selectivity, bonding or structure, or new computational methods and have relevance for the design of subsequent experiments. Physical and theoretical organic chemistry Where methods are directed towards a narrow range of structures, the importance of these targets must be clearly justified. Research that extends the known methodology to a different class of compounds is generally not suitable unless that class is significantly different in scope to previously reported methodology. Methodology studies should show a significant improvement on known methods. We welcome important research in all areas of organic synthesis, including studies on small organic molecules and biomolecules, and studies that report purely synthetic work without biological data. Total or multistep syntheses should report new or improved strategies or methods, or a more efficient route to the target compound.
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