A two-state homology model of the hERG K + channel: application to ligand binding
Rajamani, Ramkumar, Tounge, Brett A., Li, Jian, Reynolds, Charles H.
Published in Bioorganic & medicinal chemistry letters (15.03.2005)
Published in Bioorganic & medicinal chemistry letters (15.03.2005)
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Journal Article
Modeling the binding affinities of β-secretase inhibitors: application to subsite specificity
Rajamani, Ramkumar, Reynolds, Charles H.
Published in Bioorganic & medicinal chemistry letters (04.10.2004)
Published in Bioorganic & medicinal chemistry letters (04.10.2004)
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Journal Article
Linear interaction energy models for β-secretase (BACE) inhibitors: Role of van der Waals, electrostatic, and continuum-solvation terms
Tounge, Brett A., Rajamani, Ramkumar, Baxter, Ellen W., Reitz, Allen B., Reynolds, Charles H.
Published in Journal of molecular graphics & modelling (01.05.2006)
Published in Journal of molecular graphics & modelling (01.05.2006)
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Journal Article
Potent nonpeptide vasopressin receptor antagonists based on oxazino- and thiazinobenzodiazepine templates
Matthews, Jay M., Hoekstra, William J., Dyatkin, Alexey B., Hecker, Leonard R., Hlasta, Dennis J., Poulter, Brenda L., Andrade-Gordon, Patricia, de Garavilla, Lawrence, Demarest, Keith T., Ericson, Eric, Gunnet, Joseph W., Hageman, William, Look, Richard, Moore, John B., Reynolds, Charles H., Maryanoff, Bruce E.
Published in Bioorganic & medicinal chemistry letters (07.06.2004)
Published in Bioorganic & medicinal chemistry letters (07.06.2004)
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Journal Article
Designing Focused Libraries for Drug Discovery: Hit to Lead to Drug
Tropsha, Alexander, Reynolds, Charles H.
Published in Journal of molecular graphics & modelling (01.06.2002)
Published in Journal of molecular graphics & modelling (01.06.2002)
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Journal Article
GB/SA water model for the Merck molecular force field (MMFF)
Cheng, Ailan, Best, Scott A, Merz, Kenneth M, Reynolds, Charles H
Published in Journal of molecular graphics & modelling (01.06.2000)
Published in Journal of molecular graphics & modelling (01.06.2000)
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Journal Article
Improved AMBER∗ torsional parameters for the N–N rotational barrier in diacylhydrazines
Chakravorty, Subhas, Reynolds, Charles H.
Published in Journal of molecular graphics & modelling (01.10.1999)
Published in Journal of molecular graphics & modelling (01.10.1999)
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Journal Article
Comparison of baculovirus-expressed c-Abl and BCR/ABL protein tyrosine kinases
Reynolds, C H, Willson, M G, Groffen, J, Heisterkamp, N, Peakman, T C, Page, M J
Published in Biochimica et biophysica acta (30.04.1993)
Published in Biochimica et biophysica acta (30.04.1993)
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