Water-Intake and Water-Molecule Paths to the Active Site of Secretory Phospholipase A2 Studied Using MD Simulations and the Tracking Tool AQUA-DUCT

Helena D. Tjørnelund, Jesper J. Madsen, Günther H.J. Peters*

*Corresponding author for this work

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Biochemistry, Genetics and Molecular Biology

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Pharmacology, Toxicology and Pharmaceutical Science

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Earth and Planetary Sciences