Concepedia

Lipophilicity effects of monofluorination at the tertiary aliphatic carbon as a function of α-substituent

Kostiantyn P. Melnykov, Oleksandr S. Liashuk, Oleh Smyrnov, Dmytro Lesyk, Yuliia Holota, Petro Borysko, Viktor P. Yakubovskyi, Oleksandr O. Grygorenko

Journal of Fluorine Chemistry · 2024 · 10 citations · 30 references

DOI

Concepts

References

30

UCSF Chimera—A visualization system for exploratory research and analysis

Eric F. Pettersen, Thomas D. Goddard, Conrad C. Huang et al. · Journal of Computational Chemistry · 2004 · 47.8K citations

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Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy

Florian Weigend, Reinhart Ahlrichs · Physical Chemistry Chemical Physics · 2005 · 29.9K citations

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The ORCA program system

Frank Neese · Wiley Interdisciplinary Reviews Computational Molecular Science · 2011 · 13.1K citations

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Software update: the ORCA program system, version 4.0

Frank Neese · Wiley Interdisciplinary Reviews Computational Molecular Science · 2017 · 5.8K citations

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Software update: The <scp>ORCA</scp> program system—Version 5.0

Frank Neese · Wiley Interdisciplinary Reviews Computational Molecular Science · 2022 · 4.6K citations · Full text

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