Exploring protein structural dissimilarity to facilitate structure classification

od Jain, Pooja, Hirst, Jonathan D
Izdano 2009

Prediction of backbone dihedral angles and protein secondary structure using support vector machines

od Kountouris, Petros, Hirst, Jonathan D
Izdano 2009

Automatic structure classification of small proteins using random forest

od Jain, Pooja, Hirst, Jonathan D
Izdano 2010

Predicting β-turns and their types using predicted backbone dihedral angles and secondary structures

od Kountouris, Petros, Hirst, Jonathan D
Izdano 2010

Quantitative first principles calculations of protein circular dichroism in the near-ultraviolet

od Li, Zhuo, Hirst, Jonathan D.
izdano v Chem Sci (2017)

Computed optical spectra of SARS-CoV-2 proteins()

od Li, Zhuo, Hirst, Jonathan D.
izdano v Chem Phys Lett (2020)

Prediction of glycosylation sites using random forests

od Hamby, Stephen E, Hirst, Jonathan D
Izdano 2008

Benzene, Toluene, and Monosubstituted Derivatives: Diabatic Nature of the Oscillator Strengths of S(1) ← S(0) Transitions

od Robinson, David, Alarfaji, Saleh S., Hirst, Jonathan D.
izdano v J Phys Chem A (2021)

Molecular dynamics simulations and in silico peptide ligand screening of the Elk-1 ETS domain

od Hussain Abrar, Shaw Peter E, Hirst Jonathan D
Izdano 2011-11-01

Molecular dynamics simulations and in silico peptide ligand screening of the Elk-1 ETS domain

od Hussain, Abrar, Shaw, Peter E, Hirst, Jonathan D
Izdano 2011

Interpretable correlation descriptors for quantitative structure-activity relationships

od Spowage, Benson M, Bruce, Craig L, Hirst, Jonathan D
Izdano 2009

Molecular Dynamics Simulations of a Helicase

od Cox, Katherine, Watson, Tim, Soultanas, Panos, Hirst, Jonathan D.
Izdano 2003

Quantum chemical calculations of tryptophan → heme electron and excitation energy transfer rates in myoglobin

od Suess, Christian J., Hirst, Jonathan D., Besley, Nicholas A.
izdano v J Comput Chem (2017)

Docking and molecular dynamics simulations of the ternary complex nisin(2):lipid II

od Mulholland, Sam, Turpin, Eleanor R., Bonev, Boyan B., Hirst, Jonathan D.
izdano v Sci Rep (2016)

ProCKSI: a decision support system for Protein (Structure) Comparison, Knowledge, Similarity and Information

od Błażewicz Jacek, Hirst Jonathan D, Barthel Daniel, Burke Edmund K, Krasnogor Natalio
Izdano 2007-10-01

ProCKSI: a decision support system for Protein (Structure) Comparison, Knowledge, Similarity and Information

od Barthel, Daniel, Hirst, Jonathan D, Błażewicz, Jacek, Burke, Edmund K, Krasnogor, Natalio
Izdano 2007

Simulation study of chiral two dimensional ultraviolet (2DUV) spectroscopy of the protein backbone

od Abramavicius, Darius, Jiang, Jun, Bulheller, Benjamin M., Hirst, Jonathan D., Mukamel, Shaul
Izdano 2010

Ultraviolet Spectroscopy of Protein Backbone Transitions in Aqueous Solution: combined QM and MM Simulations

od Jiang, Jun, Abramavicius, Darius, Bulheller, Benjamin M., Hirst, Jonathan D., Mukamel, Shaul
Izdano 2010

Computing infrared spectra of proteins using the exciton model

od Husseini, Fouad S., Robinson, David, Hunt, Neil T., Parker, Anthony W., Hirst, Jonathan D.
izdano v J Comput Chem (2016)

Automated Alphabet Reduction for Protein Datasets

od Bacardit, Jaume, Stout, Michael, Hirst, Jonathan D, Valencia, Alfonso, Smith, Robert E, Krasnogor, Natalio
Izdano 2009