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Bayesian uncertainty analysis for complex systems biology models: emulation, global parameter searches and evaluation of gene functions (2018)
Journal Article
Vernon, I., Liu, J., Goldstein, M., Rowe, J., Topping, J., & Lindsey, K. (2018). Bayesian uncertainty analysis for complex systems biology models: emulation, global parameter searches and evaluation of gene functions. BMC systems biology, 12, Article 1. https://doi.org/10.1186/s12918-017-0484-3

Many mathematical models have now been employed across every area of systems biology. These models increasingly involve large numbers of unknown parameters, have complex structure which can result in substantial evaluation time relative to the needs... Read More about Bayesian uncertainty analysis for complex systems biology models: emulation, global parameter searches and evaluation of gene functions.

Uncertainty Analysis for Heavy Simulations of Galaxy Formation (2018)
Journal Article
Vernon, I. (2018). Uncertainty Analysis for Heavy Simulations of Galaxy Formation

Extremely complex simulations of the universe are now being performed in order to study galaxy formation. The responsible use of such simulations presents a huge challenge as it requires a comprehensive uncertainty analysis: a seemingly impossible ta... Read More about Uncertainty Analysis for Heavy Simulations of Galaxy Formation.

Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2 (2018)
Journal Article
Fugel, M., Jayatilaka, D., Hupf, E., Overgaard, J., Hathwar, V. R., Macchi, P., …Grabowsky, S. (2018). Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2. IUCrJ, 5(1), 32-44. https://doi.org/10.1107/s2052252517015548

Hirshfeld atom refinement (HAR) is a novel X-ray structure refinement technique that employs aspherical atomic scattering factors obtained from stockholder partitioning of a theoretically determined tailor-made static electron density. HAR overcomes... Read More about Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2.