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README.md
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# ASAP-OpenADMET LogD
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ASAP_OpenADMET_LogD dataset from the ASAP Discovery-OpenADMET Antiviral Drug Discovery Challenge [[1]](#1) [[2]](#2). It is intended to be used through
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[scikit-fingerprints](https://github.com/scikit-fingerprints/scikit-fingerprints) library.
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The task is to predict LogD (distribution coefficient) of molecules.
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Chodera et al.
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"The ASAP Discovery Antiviral Drug Discovery Challenge"
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https://doi.org/10.26434/chemrxiv-2025-zd9mr
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---
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# ASAP-OpenADMET LogD
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ASAP_OpenADMET_LogD dataset from the ASAP Discovery-OpenADMET Antiviral Drug Discovery Challenge [[1]](#1) [[2]](#2) [[3]](#3). It is intended to be used through
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[scikit-fingerprints](https://github.com/scikit-fingerprints/scikit-fingerprints) library.
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The task is to predict LogD (distribution coefficient) of molecules.
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Chodera et al.
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"The ASAP Discovery Antiviral Drug Discovery Challenge"
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https://doi.org/10.26434/chemrxiv-2025-zd9mr
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<a id="3">[3]</a>
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MacDermott-Opeskin, Hugo, et al.
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"A computational community blind challenge on pan-coronavirus drug discovery data"
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J. Chem. Inf. Model. 2026, 66, 6, 3129-3149
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https://doi.org/10.1021/acs.jcim.5c02106
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