title: Modeling the protonation states of the catalytic aspartates in beta-secretase.
authors.affiliation: Johnson & Johnson Pharmaceutical R&D, Welsh and McKean Roads, PO Box 776, Spring House, PA 19477, USA.
authors.forename: Ramkumar
authors.initials: R
authors.lastname: Rajamani
authors.forename: Charles H
authors.initials: CH
authors.lastname: Reynolds
mesh_terms: D053829:Amyloid Precursor Protein Secretases; D001224:Aspartic Acid / Q000737:chemistry*; D002384:Catalysis; D020134:Catalytic Domain; D010450:Endopeptidases / Q000737:chemistry*; D004791:Enzyme Inhibitors / Q000737:chemistry; D008958:Models, Molecular; D011422:Propionates / Q000737:chemistry; D011522:Protons; D011789:Quantum Theory
chemical_list: D004791:Enzyme Inhibitors; D011422:Propionates; D011522:Protons; D001224:Aspartic Acid; D053829:Amyloid Precursor Protein Secretases; D010450:Endopeptidases; C029658:propionic acid