Jonathan Hirst
Jonathan Hirst
Professor of Computational Chemistry, University of Nottingham
Bestätigte E-Mail-Adresse bei nottingham.ac.uk - Startseite
Titel
Zitiert von
Zitiert von
Jahr
Multimeme algorithms for protein structure prediction
N Krasnogor, BP Blackburne, EK Burke, JD Hirst
International Conference on Parallel Problem Solving from Nature, 769-778, 2002
2412002
Modeling the amide I bands of small peptides
T la Cour Jansen, AG Dijkstra, TM Watson, JD Hirst, J Knoester
The Journal of chemical physics 125 (4), 044312, 2006
1892006
Prediction of glycosylation sites using random forests
SE Hamby, JD Hirst
BMC bioinformatics 9 (1), 500, 2008
1882008
Assessing energy functions for flexible docking
M Vieth, JD Hirst, A Kolinski, CL Brooks III
Journal of Computational Chemistry 19 (14), 1612-1622, 1998
1831998
Circular and linear dichroism of proteins
BM Bulheller, A Rodger, JD Hirst
Physical Chemistry Chemical Physics 9 (17), 2020-2035, 2007
1812007
Theoretical studies toward quantitative protein circular dichroism calculations
NA Besley, JD Hirst
Journal of the American Chemical Society 121 (41), 9636-9644, 1999
1581999
Machine learning in virtual screening
JL Melville, EK Burke, JD Hirst
Combinatorial chemistry & high throughput screening 12 (4), 332-343, 2009
1572009
Prediction of structural and functional features of protein and nucleic acid sequences by artificial neural networks
JD Hirst, MJE Sternberg
Biochemistry 31 (32), 7211-7218, 1992
1481992
Assessing search strategies for flexible docking
M Vieth, JD Hirst, BN Dominy, H Daigler, CL Brooks III
Journal of computational chemistry 19 (14), 1623-1631, 1998
1451998
Contemporary QSAR classifiers compared
CL Bruce, JL Melville, SD Pickett, JD Hirst
Journal of chemical information and modeling 47 (1), 219-227, 2007
1422007
Do active site conformations of small ligands correspond to low free-energy solution structures?
M Vieth, JD Hirst, CL Brooks
Journal of computer-aided molecular design 12 (6), 563-572, 1998
1101998
DichroCalc—circular and linear dichroism online
BM Bulheller, JD Hirst
Bioinformatics 25 (4), 539-540, 2009
1092009
Ab initio study of the electronic spectrum of formamide with explicit solvent
NA Besley, JD Hirst
Journal of the American Chemical Society 121 (37), 8559-8566, 1999
1051999
Helicity, circular dichroism and molecular dynamics of proteins
JD Hirst, CL Brooks III
Journal of molecular biology 243 (2), 173-178, 1994
1011994
Quantitative structure-activity relationships by neural networks and inductive logic programming. I. The inhibition of dihydrofolate reductase by pyrimidines
JD Hirst, RD King, MJE Sternberg
Journal of Computer-Aided Molecular Design 8 (4), 405-420, 1994
981994
Molecular Dynamics Simulations of Isolated Helixes of Myoglobin
JD Hirst, CL Brooks III
Biochemistry 34 (23), 7614-7621, 1995
901995
Protein secondary structure prediction with dihedral angles
MJ Wood, JD Hirst
PROTEINS: Structure, Function, and Bioinformatics 59 (3), 476-481, 2005
892005
Stabilizing interactions between aromatic and basic side chains in α-helical peptides and proteins. Tyrosine effects on helix circular dichroism
CD Andrew, S Bhattacharjee, N Kokkoni, JD Hirst, GR Jones, AJ Doig
Journal of the American Chemical Society 124 (43), 12706-12714, 2002
892002
Supervised machine learning algorithms for protein structure classification
P Jain, JM Garibaldi, JD Hirst
Computational biology and chemistry 33 (3), 216-223, 2009
842009
First-principles calculations of protein circular dichroism in the near ultraviolet
DM Rogers, JD Hirst
Biochemistry 43 (34), 11092-11102, 2004
782004
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