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Molblock and CXSmiles support for alignment/coordinates preservation #154

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MichelML opened this issue Oct 29, 2022 · 0 comments
Open

Molblock and CXSmiles support for alignment/coordinates preservation #154

MichelML opened this issue Oct 29, 2022 · 0 comments

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@MichelML
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MichelML commented Oct 29, 2022 •
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The main reason we use rdkit-js over this library at the moment is because smiles-drawer has no support for molblock and cxsmiles, and thus no way to "align" molecules on the fly or depict a molecule with specified coordinates.

We however like the lightweight and no-wasm module approach of this library, thus having molblock and cxsmiles would be a potential factor for us to adopt the library 👍
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@MichelML