Research output per year
Research output per year
Research output
- 8 Article
Search results
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2014
Rapid Decomposition and Visualisation of Protein-Ligand Binding Free Energies by Residue and by Water
CJ, W., M, M., Michel, J., Ben, L., S, M.-S. & AJ, M., 1 Nov 2014, In: Faraday Discussions. 169, p. 477-499Research output: Contribution to journal › Article › peer-review
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Evaluation of Host/Guest Binding Thermodynamics of Model Cavities with Grid Cell Theory
Michel, J., Henchman, R. H., Gerogiokas, G., Southey, M. W. Y., Mazanetz, M. P. & Law, R., 9 Sept 2014, In: Journal of Chemical Theory and Computation. 10, 9, p. 4055–4068Research output: Contribution to journal › Article › peer-review
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Strategies to Calculate Water Binding Free Energies in Protein-Ligand Complexes
Bodnarchuk, M., Viner, R., Michel, J. & Essex, J. W., 23 Jun 2014, In: Journal of Chemical Information and Modeling. 54, 6, p. 1623–1633Research output: Contribution to journal › Article › peer-review
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Current and emerging opportunities for molecular simulations in structure-based drug design
Michel, J., 15 Jan 2014, In: Physical Chemistry Chemical Physics. 16, 10, p. 4465-4477 13 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile -
Prediction of Small Molecule Hydration Thermodynamics with Grid Cell Theory
Gerogiokas, G., Calabro, G., Henchman, R. H., Southey, M. W. Y., Law, R. J. & Michel, J., Jan 2014, In: Journal of Chemical Theory and Computation. 10, 1, p. 35-48 14 p.Research output: Contribution to journal › Article › peer-review
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2012
Luminescent, Enantiopure, Phenylatopyridine Iridium-Based Coordination Capsules
Chepelin, O., Ujma, J., Wu, X., Slawin, A. M. Z., Pitak, M. B., Coles, S. J., Michel, J., Jones, A. C., Barran, P. E. & Lusby, P. J., 28 Nov 2012, In: Journal of the American Chemical Society. 134, 47, p. 19334-19337 4 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile -
Mechanisms of small-molecule binding to intrinsically disordered proteins
Cuchillo, R. & Michel, J., Oct 2012, In: Biochemical Society Transactions. 40, 5, p. 1004-1008 5 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile -
The Impact of Small Molecule Binding on the Energy Landscape of the Intrinsically Disordered Protein C-Myc
Michel, J. & Cuchillo, R., 16 Jul 2012, In: PLoS ONE. 7, 7, p. - 13 p., e41070.Research output: Contribution to journal › Article › peer-review
Open AccessFile