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restore space as delimiter for string-based definition of InChI options#846

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johnmay merged 2 commits intocdk:masterfrom
marco-foscato:master
Mar 7, 2022
Merged

restore space as delimiter for string-based definition of InChI options#846
johnmay merged 2 commits intocdk:masterfrom
marco-foscato:master

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@marco-foscato
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Fixes #845

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johnmay commented Mar 6, 2022

Thanks just running the tests but looks fine - I wonder if maybe it should be both String and Comma - it definitely used to be space though as I noted it was essentially like command line args. "-15T -KET" etc - annoyingly on Windows you needed to use "/15T /KET"

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I wonder if maybe it should be both String and Comma

Me too. I'm sending a new PR where one can use both comma and space.

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I'm sending a new PR

Actually, it's not a "new PR". I've committed the new changes to this same branch, so it already in this PR.

@johnmay johnmay merged commit 2726726 into cdk:master Mar 7, 2022
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johnmay commented Mar 7, 2022

Thanks

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Option for InChIGenerator: comma or space delimited?

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