Roderick Hubbard
机构: University of York and Vernalis (R&D) Ltd
每年引用次数
引用次数
引用: 24,325
H-指数: 63
I10-指数 : 134
出版物: 268
Design of Leucine-Rich Repeat Kinase 2 (LRRK2) Inhibitors Using a Crystallographic Surrogate Derived from Checkpoint Kinase 1 (CHK1).
Douglas S. Williamson , Garrick P. Smith , Pamela Acheson-Dossang , Simon T. Bedford
Journal of Medicinal Chemistry 60 ( 21) 8945 -8962
15
2017
Discovery of Selective Small-Molecule Activators of a Bacterial Glycoside Hydrolase.
John F. Darby , Jens Landström , Christian Roth , Yuan He
Angewandte Chemie 53 ( 49) 13419 -13423
25
2014
Fragment-derived modulators of an industrial β-glucosidase
Eleni Makraki , John F. Darby , Marta G. Carneiro , James D. Firth
Biochemical Journal 477 ( 22) 4383 -4395
2020
Using Experimental Information to Produce a Model of the Transmembrane Domain of the Ion Channel Phospholamban
Pawel Herzyk , Roderick E. Hubbard
Biophysical Journal 74 ( 3) 1203 -1214
27
1998
HOOK: a program for finding novel molecular architectures that satisfy the chemical and steric requirements of a macromolecule binding site.
Michael B. Eisen , Don C. Wiley , Martin Karplus , Roderick E. Hubbard
Proteins 19 ( 3) 199 -221
229
1994
Computers and Protein Crystallography
David J. Edwards , Roderick E. Hubbard
Computer Applications in Pharmaceutical Research and Development 275 -299
2006
Temperature Effects on Protein Motions: A Molecular Dynamics Study of RNase-Sa
Radovan Dvorsky , Josef Sevcik , Leo S. D. Caves , Roderick E. Hubbard
Journal of Physical Chemistry B 104 ( 44) 10387 -10397
18
2000
Identifying key electrostatic interactions in Rhizomucor miehei lipase: the influence of solvent dielectric
Sanna Jääskeläine , Chandra S. Verma , Roderick E. Hubbard , Leo S. D. Caves
Theoretical Chemistry Accounts 101 ( 1) 175 -179
11
1999
What can structure tell us about function in the estrogen receptors
Roderick E. Hubbard
Pharmacochemistry Library 32 53 -56
2002
Lessons for fragment library design: analysis of output from multiple screening campaigns
I-Jen Chen , Roderick E. Hubbard
Journal of Computer-Aided Molecular Design 23 ( 8) 603 -620
92
2009
Establishing Drug Discovery and Identification of Hit Series for the Anti-apoptotic Proteins, Bcl-2 and Mcl-1.
James B. Murray , James Davidson , Ijen Chen , Ben Davis
Acs Omega 4 ( 5) 8892 -8906
6
2019
Ligand-induced conformational change in penicillin acylase.
Sarah H. Done , James A. Brannigan , Peter C.E. Moody , Roderick E. Hubbard
Journal of Molecular Biology 284 ( 2) 463 -475
88
1998
Understanding the mechanism of ice binding by type III antifreeze proteins
Alfred A. Antson , Derek J. Smith , David I. Roper , Sally Lewis
Journal of Molecular Biology 305 ( 4) 875 -889
99
2001
Novel, potent small-molecule inhibitors of the molecular chaperone Hsp90 discovered through structure-based design.
Brian W. Dymock , Xavier Barril , Paul A. Brough , Julie E. Cansfield
Journal of Medicinal Chemistry 48 ( 13) 4212 -4215
191
2005
Structure-based drug discovery and protein targets in the CNS
Roderick E. Hubbard
Neuropharmacology 60 ( 1) 7 -23
23
2011
Introduction to the special issue on High Resolution Neuropharmacology.
Graham L. Collingridge , Jean-Philippe Pin , Roderick E. Hubbard , Janos P. Kiss
Neuropharmacology 60 ( 1) 1 -2
2
2011
Experimental and computational mapping of the binding surface of a crystalline protein.
Andrew C. English , Colin R. Groom , Roderick E. Hubbard
Protein Engineering 14 ( 1) 47 -59
94
2001
Apomyoglobin as a molecular recognition surface: expression, reconstitution and crystallization of recombinant porcine myoglobin in Escherichia coli
Guy Dodson , Roderick E. Hubbard , Tom J. Oldfield , Stephen J. Smerdon
Protein Engineering 2 ( 3) 233 -237
23
1988
rDock: A Fast, Versatile and Open Source Program for Docking Ligands to Proteins and Nucleic Acids
Sergio Ruiz-Carmona , Daniel Alvarez-Garcia , Nicolas Foloppe , A. Beatriz Garmendia-Doval
PLoS Computational Biology 10 ( 4) e1003571
418
2014
Combining Hit Identification Strategies: Fragment-Based and in Silico Approaches to Orally Active 2-Aminothieno[2,3-d]pyrimidine Inhibitors of the Hsp90 Molecular Chaperone
Angela Merrett , Antony Padfield , Rachel Parsons , Thomas Radimerski
Journal of Medicinal Chemistry 52 ( 15) 4794 -4809
134
2009