Jakub Kostal

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The article draws primarily from the behavioral findings (mainly psychiatric and psychological observations) and points out the important relationships between attention-deficit/hyperactivity disorder (ADHD) symptoms and time orientation. Specifically, the authors argue that there is a significant overlap between the symptoms of ADHD and Present Hedonism.(More)
Hybrid quantum mechanics and molecular mechanics (QM/MM) computer simulations have become an indispensable tool for studying chemical and biological phenomena for systems too large to treat with QM alone. For several decades, semiempirical QM methods have been used in QM/MM simulations. However, with increased computational resources, the introduction of ab(More)
a 5 In their article, Voutchkova et al. 1 " derive property guidelines for the design of chemicals with reduced acute aquatic toxicity to multiple species " using properties such as " chemical solubilities, size, shape and molecular orbital energies. " The authors claim to use a dataset of " 865 neutral organic compounds, " and then 10 proceed to " predict(More)
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