Publications

Here is a list of publication from the SCAMs@bristol group and Andrew.

A general approach to maximise information density in neutron reflectometry analysis
Mach. Learn.: Sci Technol., 1 (3), 14850, 2020 — Paper | ESI | Data | arXiv
Andrew R. McCluskey*, Thomas Arnold, Joshanial F. K. Cooper, Tim Snow
Outlining and applying a Bayesian model selection framework for neutron reflectometry analysis.

uravu: Making Bayesian modelling easy(er)
J. Open Source Softw., 5 (50), 2214, 2020 — Paper | Code | Docs
Andrew R. McCluskey*, Tim Snow
A straightforward library for Bayesian data analysis.

Assessing molecular simulation for the analysis of lipid monolayer reflectometry
J. Phys. Comm., 3 (7), 31233, 2019 — Paper | ESI | Data | arXiv
Andrew R. McCluskey*, James Grant, Andrew J. Smith, Jonathan L. Rawle, David J. Barlow, M. Jayne Lawrence, Stephen C. Parker, Karen J. Edler*
Comparing different molecular dynamics potential models to improve reflectometry analysis.

Coarse-grained modelling for soft matter scattering
University of Bath, PhD Thesis, 2019 — Thesis | ESI
Andrew R. McCluskey
An investigation of different coarse-graining methods to develop the analysis of scattering from soft matter species.

An introduction to classical molecular dynamics simulation for experimental scattering users
J. Appl. Crystallogr., 52 (3), 655, 2019 — Paper | OER | arXiv
Andrew R. McCluskey*, James Grant, Adam R. Symington, Tim Snow, James Doutch, Benjamin J. Morgan*, Stephen C. Parker, Karen J. Edler
An open educational resource to engage users of scattering techniques in classical simulation.

Bayesian determination of the effect of a deep eutectic solvent on the structure of lipid monolayers
Phys. Chem. Chem. Phys., 21 (11), 6133, 2019 — Paper | ESI | Data | arXiv
Andrew R. McCluskey*, Adrian Sanchez-Fernandez, Karen J. Edler, Stephen C. Parker, Andrew J. Jackson, Richard A. Campbell, Thomas Arnold*
A novel reflectometry analysis method reveals the structure of lipid monolayers at the air-DES interface.

pylj: A teaching tool for classical atomistic simulation
J. Open Source Educ., 1 (2), 19, 2018 — Paper | Code | Docs
Andrew R. McCluskey*, Benjamin J. Morgan, Karen J. Edler, Stephen C. Parker
pylj is an educational software to introduce students to classical atomistic simulation using a Lennnard-Jones potential model.

Model-dependent Small-angle Scattering for the Study of Complex Organic Material
Curr. Org. Chem., 22 (8), 750, 2018 — Paper
Andrew R. McCluskey, Karen J. Edler*
This review article introduces the method of model-dependent analysis of small angle scattering.

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