Concepedia

Structural and physico-chemical evaluation of melatonin and its solution-state excited properties, with emphasis on its binding with novel coronavirus proteins

Nabil Al‐Zaqri, T. Pooventhiran, Ali Alsalme, Ismail Warad, Athira Maria John, Renjith Thomas

Journal of Molecular Liquids · 2020 · 79 citations · 45 references

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45

Multiwfn: A multifunctional wavefunction analyzer

Tian Lu, Feiwu Chen · Journal of Computational Chemistry · 2011 · 43K citations

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Revealing Noncovalent Interactions

Erin R. Johnson, Shahar Keinan, Paula Mori‐Sánchez et al. · Journal of the American Chemical Society · 2010 · 9.3K citations

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Absolute hardness: companion parameter to absolute electronegativity

Robert G. Parr, Ralph G. Pearson · Journal of the American Chemical Society · 1983 · 7.8K citations

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Structure of Mpro from SARS-CoV-2 and discovery of its inhibitors

Zhenming Jin, Xiaoyu Du, Yechun Xu et al. · Nature · 2020 · 4.5K citations · Full text

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Gabedit—A graphical user interface for computational chemistry softwares

A. Allouche · Journal of Computational Chemistry · 2010 · 2.4K citations · Full text

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