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An-Analysis-of-Overfitting-In-Modern-QSAR-Models.pdf (483.74 kB)

An Analysis of Overfitting in Modern QSAR Models

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Version 2 2022-08-30, 14:13
Version 1 2022-08-17, 19:03
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posted on 2022-08-30, 14:13 authored by Nathaniel Charest, Christian Ramsland, Todd Martin, Antony Williams, Gabriel Sinclair

Presentation for Fall ACS on August 21-25, 2022 in Chicago IL


Science Inventory, CCTE products: https://cfpub.epa.gov/si/si_public_search_results.cfm?advSearch=true&showCriteria=2&keyword=CCTE&TIMSType=&TIMSSubTypeID=&epaNumber=&ombCat=Any&dateBeginPublishedPresented=07/01/2017&dateEndPublishedPresented=&dateBeginUpdated=&dateEndUpdated=&DEID=&personName=&personID=&role=Any&journalName=&journalID=&publisherName=&publisherID=&sortBy=pubDate&count=25

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