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Chlorophyll a and Chlorophyll b #13

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allanmorcelli opened this issue Feb 13, 2020 · 0 comments
Open

Chlorophyll a and Chlorophyll b #13

allanmorcelli opened this issue Feb 13, 2020 · 0 comments

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@allanmorcelli
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Hello, I would like to request the inclusion of chlorophyll a and chlorophyll b in LVPP's sigma-profile database for COSMO-based models.

chlorophylls.zip

Files containing molecules with minimum energy structures are attached. Please verify your agreement with these structures since I found a variety of representations to the bonds with Mg in these molecules.

Best regards,

Allan Morcelli
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