Shina C L Kamerlin

Coarse-grained (multiscale) simulations in studies of biophysical and chemical systems.

Arieh Warshel, Shina C L Kamerlin, Spyridon Vicatos, 2011, Annual review of physical chemistry.

The EVB as a quantitative tool for formulating simulations and analyzing biological and chemical reactions.

Arieh Warshel, Shina C L Kamerlin, A. Warshel, 2010, Faraday discussions.

Enzyme millisecond conformational dynamics do not catalyze the chemical step

Arieh Warshel, Jie Cao, Shina C L Kamerlin, 2009, Proceedings of the National Academy of Sciences.

The role of metal ions in phosphate ester hydrolysis.

Shina C L Kamerlin, John Wilkie, S. C. Kamerlin, 2007, Organic & biomolecular chemistry.

On unjustifiably misrepresenting the EVB approach while simultaneously adopting it.

Arieh Warshel, Jie Cao, Edina Rosta, 2009, The journal of physical chemistry. B.

Relative Binding Energies Predict Crystallographic Binding Modes of Ethionamide Booster Lead Compounds

Shina C L Kamerlin, Ehmke Pohl, Fernanda Duarte, 2019, The journal of physical chemistry letters.

Paradynamics: an effective and reliable model for ab initio QM/MM free-energy calculations and related tasks.

Arieh Warshel, Nikolay V Plotnikov, Shina C L Kamerlin, 2011, The journal of physical chemistry. B.

Progress in ab initio QM/MM free-energy simulations of electrostatic energies in proteins: accelerated QM/MM studies of pKa, redox reactions and solvation free energies.

Arieh Warshel, Maciej Haranczyk, Shina C L Kamerlin, 2009, The journal of physical chemistry. B.

On the interpretation of the observed linear free energy relationship in phosphate hydrolysis: a thorough computational study of phosphate diester hydrolysis in solution.

Arieh Warshel, Edina Rosta, Shina C L Kamerlin, 2008, Biochemistry.