Deep-Learning Architecture in QSPR Modeling for the Prediction of Energy Conversion Efficiency of Solar Cells
Sign Up to like & getrecommendations! Published in 2020 at "Industrial & Engineering Chemistry Research"
DOI: 10.1021/acs.iecr.0c03880
Abstract: The efficient and effective design of chemical processes and products heavily relies on the accurate prediction of essential properties. In this work, a deep-learning architecture integrating a bid... read more here.
Keywords: qspr modeling; architecture qspr; modeling prediction; deep learning ... See more keywords
QSPR Modeling and Experimental Determination of the Antioxidant Activity of Some Polycyclic Compounds in the Radical-Chain Oxidation Reaction of Organic Substrates
Sign Up to like & getrecommendations! Published in 2022 at "Molecules"
DOI: 10.3390/molecules27196511
Abstract: The present work addresses the quantitative structure–antioxidant activity relationship in a series of 148 sulfur-containing alkylphenols, natural phenols, chromane, betulonic and betulinic acids, and 20-hydroxyecdysone using GUSAR2019 software. Statistically significant valid models were constructed to… read more here.
Keywords: oxidation; modeling experimental; antioxidant activity; qspr modeling ... See more keywords