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Allow more elements per line in SMILES file #40

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FelixBaensch opened this issue Feb 20, 2024 · 4 comments
Closed

Allow more elements per line in SMILES file #40

FelixBaensch opened this issue Feb 20, 2024 · 4 comments
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@JonasSchaub
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enhancement New feature or request

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@FelixBaensch
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@FelixBaensch FelixBaensch added the enhancement New feature or request label Feb 20, 2024
@JonasSchaub
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Could you elaborate a bit more?

@JonasSchaub JonasSchaub self-assigned this Feb 20, 2024
@FelixBaensch
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At the moment the SMILES importer is very restrictive and only allows 2 entries per line separated by a separator, i.e. if I have a file with an additional entry, it will not be read. This is not very practical for a "loose" format like a text file containing SMILES.

@JonasSchaub
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I think this was actually the point in #31

@FelixBaensch
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Then this can be closed and I'll at my points to #31.

Closed as duplicated of #31

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@JonasSchaub @FelixBaensch