S. X. M. Boerrigter

Significant progress in predicting the crystal structures of small organic molecules – a report on the fourth blind test

Graeme M. Day, Timothy G. Cooper, Aurora J. Cruz‐Cabeza et al. · Acta Crystallographica Section B Structural Science · 2009 · 446 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +14

Towards crystal structure prediction of complex organic compounds – a report on the fifth blind test

David A. Bardwell, Claire S. Adjiman, Yelena A. Arnautova et al. · Acta Crystallographica Section B Structural Science · 2011 · 432 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +13

A third blind test of crystal structure prediction

Graeme M. Day, W.D.S. Motherwell, Herman L. Ammon et al. · Acta Crystallographica Section B Structural Science · 2005 · 432 citations · Full text

Natural Sciences, Chemistry, Materials Science +13

Cocrystals of nutraceuticalp-coumaric acid with caffeine and theophylline: polymorphism and solid-state stability explored in detail using their crystal graphs

N. Schultheiss, Melanie Roe, S. X. M. Boerrigter · CrystEngComm · 2010 · 86 citations

Natural Sciences, Chemistry, Medicinal Chemistry +16

MONTY:  Monte Carlo Crystal Growth on Any Crystal Structure in Any Crystallographic Orientation; Application to Fats

S. X. M. Boerrigter, G. P. H. Josten, Jacco van de Streek et al. · The Journal of Physical Chemistry A · 2004 · 85 citations

Natural Sciences, Chemistry, Materials Science +17