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Bennett acceptance ratio method to calculate the binding free energy of BACE1 inhibitors: Theoretical model and design of new ligands of the enzyme
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Comparison of thermodynamic integration and Bennett acceptance ratio for calculating relative protein‐ligand binding free energies
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Conformational restriction approach to β-secretase (BACE1) inhibitors III: Effective investigation of the binding mode by combinational use of X-ray analysis, isothermal titration calorimetry and theoretical calculations
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Evaluation of transition-state mimics in a superior BACE1 cleavage sequence as peptide-mimetic BACE1 inhibitors
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Discovery of an orally efficaceous 4-phenoxypyrrolidine-based BACE-1 inhibitor
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Tyramine fragment binding to BACE-1
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Significance of interactions of BACE1–Arg235 with its ligands and design of BACE1 inhibitors with P2 pyridine scaffold
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Piperazine sulfonamide BACE1 inhibitors: Design, synthesis, and in vivo characterization
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Structure based design of iminohydantoin BACE1 inhibitors: Identification of an orally available, centrally active BACE1 inhibitor
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Discovery of potent iminoheterocycle BACE1 inhibitors
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Virtual Screening for β-Secretase (BACE1) Inhibitors Reveals the Importance of Protonation States at Asp32 and Asp228
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Design, Synthesis, and X-ray Structure of Potent Memapsin 2 (β-Secretase) Inhibitors with Isophthalamide Derivatives as the P2-P3-Ligands
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2-Amino-3,4-dihydroquinazolines as Inhibitors of BACE-1 (β-Site APP Cleaving Enzyme): Use of Structure Based Design to Convert a Micromolar Hit into a Nanomolar Lead
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From Fragment Screening to In Vivo Efficacy: Optimization of a Series of 2-Aminoquinolines as Potent Inhibitors of Beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1)
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Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Modeling of BACE-1 Inhibitors as Anti-Alzheimer’s Agents
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