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CaspNeuroD: a knowledgebase of predicted caspase cleavage sites in human proteins related to neurodegenerative diseases.

, and . Database J. Biol. Databases Curation, (2016)

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Peptide mimetics as enzyme inhibitors: Use of free energy perturbation calculations to evaluate isosteric replacement for amide bonds in a potent HIV protease inhibitor., and . J. Comput. Aided Mol. Des., 7 (3): 291-304 (1993)R.E.DD.B.: A database for RESP and ESP atomic charges, and force field libraries., , , , , , and . Nucleic Acids Res., 36 (Database-Issue): 360-367 (2008)PMAP: databases for analyzing proteolytic events and pathways., , , , , , , , , and 6 other author(s). Nucleic Acids Res., 37 (Database-Issue): 611-618 (2009)CaspNeuroD: a knowledgebase of predicted caspase cleavage sites in human proteins related to neurodegenerative diseases., and . Database J. Biol. Databases Curation, (2016)A Molecular Mechanical Model That Reproduces the Relative Energies for Chair and Twist-Boat Conformations of 1, 3-Dioxanes., , and . J. Comput. Chem., 16 (2): 243-262 (1995)Quantitative profiling of protease specificity., , , , and . PLoS Comput. Biol., (2021)Molecular mechanical models for organic and biological systems going beyond the atom centered two body additive approximation: aqueous solution free energies of methanol and N-methyl acetamide, nucleic acid base, and amide hydrogen bonding and chloroform/water partition coefficients of the nucleic acid bases., , and . J. Comput. Chem., 22 (10): 1048-1057 (2001)Relative free energies of binding to thymidylate synthase of 2- and/or 4-thio and/or 5-fluoro analogues of dUMP., , , and . J. Comput. Aided Mol. Des., 17 (10): 699-710 (2003)5, 10-Methylene-5, 6, 7, 8-tetrahydrofolate conformational transitions upon binding to thymidylate synthase: molecular mechanics and continuum solvent studies., , and . J. Comput. Aided Mol. Des., 19 (2): 123-136 (2005)How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules?, , and . J. Comput. Chem., 21 (12): 1049-1074 (2000)