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Add buried volumes calculated including hydrogens to descriptors #11

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akalikadien opened this issue Aug 10, 2023 · 0 comments
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@akalikadien
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All current buried volume descriptors exclude hydrogens. It might be interesting to analyse the ones including the hydrogens too since this might be of significance to some structures.
For every buried volume we can add an extra entry e.g. buried_volume_including_hs_donor_max

@akalikadien akalikadien added the enhancement New feature or request label Aug 10, 2023
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