Items where authors include "Cosgrove, D.A."

Article

Seddon, M.P., Cosgrove, D.A., Packer, M.J. et al. (1 more author) (2019) Alignment-free molecular shape comparison using spectral geometry: the framework. Journal of Chemical Information and Modeling, 59 (1). pp. 98-116. ISSN 1549-9596

Gillet, V. orcid.org/0000-0002-8403-3111, Seddon, M.P. and Cosgrove, D.A. (2018) Bioisosteric replacements extracted from high quality structures in the protein databank. ChemMedChem, 13 (6). pp. 607-613. ISSN 1860-7179

Gan, S., Cosgrove, D.A., Gardiner, E.J. et al. (1 more author) (2014) Investigation of the Use of Spectral Clustering for the Analysis of Molecular Data. Journal of Chemical Information and Modeling, 54 (12). 3302 - 3319. ISSN 1549-9596

Taylor, R., Cole, J.C., Cosgrove, D.A. et al. (3 more authors) (2012) Development and validation of an improved algorithm for overlaying flexible molecules. Journal of Computer-Aided Molecular Design, 26 (4). 451 - 472.