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* 1. Target compound identifier

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* 3. Name of the attached folder (.zip)

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* 4. Author names, affiliations, addresses, emails, ORCID ID (if available)

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* 5. Lead author name

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* 6. Primary contact email address (this is the address the CCDC will use to contact regarding the submission)

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* 7. A brief description of the methodology applied.


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* 8. Computational time taken to generate the attached results (CPU hours)

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* 9. Outline of computational hardware utilised.

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* 10. Supporting statement(s)

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