Sarah E. Wright
University of Manchester
9 Papers
12 Citations
Sarah E. Wright is an academic researcher from University of Manchester. The author has contributed to research in topics: Crystal structure prediction & van der Waals force. The author has an hindex of 4, co-authored 6 publications.
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Papers
The interplay of intra- and intermolecular errors in modeling conformational polymorphs.
TL;DR: In this article , the authors examined 54 molecular conformations from 20 sets of conformational polymorphs, along with the relative lattice energies and 173 dimer interactions taken from six of the polymorph sets.
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Can solvated intermediates inform us about nucleation pathways? The case of β-pABA
Aurora J. Cruz-Cabeza,E. Taylor,Isaac J. Sugden,David H. Bowskill,Sarah E. Wright,H. Abdullahi,D. Tulegenov,Ghazala Sadiq,Roger J. Davey +8 more
TL;DR: In this paper, an in-depth crystallographic analysis related to the nucleation of the α and β polymorphs of para-aminobenzoic acid in an attempt to reveal the pathways leading to the two forms.
Is it usual to be unusual? An investigation into molecular conformations in organic crystals
TL;DR: In this paper, a new way of identifying unusual conformations in molecular crystals from distributions of torsions in the Cambridge Structural Database (CSD) is presented. But the method is not suitable for the detection of unusual torsion unusualness with regards to conformational adjustment and conformational change.
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Crystal size, shape, and conformational changes drive both the disappearance and reappearance of ritonavir polymorphs in the mill.
P. Sacchi,Sarah E. Wright,Petros Neoptolemou,Giulio I. Lampronti,Ashwin Kumar Rajagopalan,Weronika Kras,Caitlin L Evans,Paul Hodgkinson,Aurora J. Cruz-Cabeza +8 more
TL;DR: This work shows that RVR's extraordinary disappearing polymorph as well as its reluctant form can be consistently produced by ball-milling under different environmental conditions, and highlights the huge potential of mechanochemistry in polymorph discovery of forms initially difficult to nucleate, recovery of disappearing polymorphs, and polymorph control of complex flexible drug compounds.
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