List of works by Stephen A Wells

'Something in the way she moves': The functional significance of flexibility in the multiple roles of protein disulfide isomerase (PDI).

scientific article published on 24 August 2017

A complete thermodynamic analysis of enzyme turnover links the free energy landscape to enzyme catalysis

scholarly article

Defining the flexibility window in ordered aluminosilicate zeolites

scientific article published on 27 September 2017

Exploring the energy landscapes of protein folding simulations with Bayesian computation.

scientific article published on 21 February 2012

Fitting low-resolution cryo-EM maps of proteins using constrained geometric simulations.

scientific article

Flexibility windows and compression of monoclinic and orthorhombic silicalites

scholarly article in Physical Review B, vol. 85 no. 6, February 2012

Geometric simulation of perovskite frameworks with Jahn-Teller distortions: applications to the cubic manganites.

scientific article

High-resolution NMR studies of structure and dynamics of human ERp27 indicate extensive interdomain flexibility

scientific article

In Silico and Structural Analyses Demonstrate That Intrinsic Protein Motions Guide T Cell Receptor Complementarity Determining Region Loop Flexibility.

scientific article published on 11 April 2018

Intrinsic Flexibility of the EMT Zeolite Framework under Pressure

scientific article published on 12 February 2019

Intrinsic flexibility of porous materials; theory, modelling and the flexibility window of the EMT zeolite framework

scientific article

Negative thermal expansion in ZrW2O8: mechanisms, rigid unit modes, and neutron total scattering

scientific article published on 12 December 2005

Pressure-induced symmetry changes in body-centred cubic zeolites

scientific article published on 24 July 2019

Protein flexibility is key to cisplatin crosslinking in calmodulin.

scientific article

Rigidity, normal modes and flexible motion of a SARS-CoV-2 (COVID-19) protease structure

scientific article (preprint)

Salt bridge impact on global rigidity and thermostability in thermophilic citrate synthase

scientific article published on 08 November 2019

Structure and Function in Homodimeric Enzymes: Simulations of Cooperative and Independent Functional Motions.

scientific article

Structure and function of L-threonine-3-dehydrogenase from the parasitic protozoan Trypanosoma brucei revealed by X-ray crystallography and geometric simulations

scientific article published on 03 September 2018

Template-Based Geometric Simulation of Flexible Frameworks.

scientific article published on 12 March 2012

The flexibility and dynamics of protein disulfide isomerase.

scientific article published on 12 September 2016

The flexibility window in zeolites.

scientific article published on 19 November 2006

Thermal stability, storage and release of proteins with tailored fit in silica

scientific article published on 24 April 2017

X-ray, spectroscopic and normal-mode dynamics of calexcitin: structure-function studies of a neuronal calcium-signalling protein

scientific article

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