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Molecular modeling study on the water-electrode surface interaction in hydrovoltaic energy
(Nature, 2023)
The global energy problem caused by the decrease in fossil fuel sources, which have negative effects on human health and the environment, has made it necessary to research alternative energy sources. Renewable energy sources ...
Pyrimidine and cumene derivatives functionalized by hydroxy and methoxy: Computational insights in drug-likeness, ADM, and toxicity studies
(Elsevier, 2023)
The –OH and –OCH3 functionalized isopropyl cumene and isopropyl pyrimidine derivatives were designed and,
explored in terms of the ADM, and possible toxic effects in view of the medicinal and environmental. For this
goal, ...
Computational Insights in Drug-likeness and ADMT Properties of -dienes Resemble of Geranial
(Dergipark, 2023)
This research aims to analyze the drug development potential of geranial, a naturally occurring compound
known for its medicinal properties, through in-depth ADMT (Absorption, Distribution, Metabolism, and
Toxicity) ...