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Enantioselective Proteins: Selection, Binding Studies and Molecular Modeling of Antibodies with Affinity towards Hydrophobic BINOL Derivatives.
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Synthesis of uronic-Noeurostegine –a potent bacterial β-glucuronidase inhibitor.
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Organocatalytic Asymmetric 1,6-Addition/1,4-Addition Sequence to 2,4-Dienals for the Synthesis of Chiral Chromans.
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Molecular Dynamics Using Nonvariational Polarizable Force Fields: Theory, Periodic Boundary Conditions Implementation, and Application to the Bond Capacity Model.
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Quantifying Intramolecular Basis Set Superposition Errors.
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Insight into the molecular mechanism behind PEG-mediated stabilization of biofluid lipases.
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Enantioselective Organocatalytic Cascade Approach to Different Classes of Benzofused Acetals.
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Water-mediated interactions influence the binding of thapsigargin to sarco/endoplasmic reticulum calcium adenosinetriphosphatase.
Journal of Medicinal Chemistry,
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Bovine Chymosin: A Computational Study of Recognition and Binding of Bovine κ-Casein.
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