Yelena A. Arnautova

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 · 440 citations · Full text

Small Organic Molecules, Crystal Structure, Engineering +15

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 · 426 citations · Full text

Materials Science, Crystal Structure, Engineering +14

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 · 426 citations · Full text

Materials Science, Crystal Structure, Engineering +14

Recent improvements in prediction of protein structure by global optimization of a potential energy function

Jarosław Pillardy, Cezary Czaplewski, Adam Liwo et al. · Proceedings of the National Academy of Sciences · 2001 · 160 citations · Full text

Free Energy, Potential Energy Function, Biochemistry +15

Physics-based protein-structure prediction using a hierarchical protocol based on the UNRES force field: Assessment in two blind tests

Stanisław Ołdziej, Cezary Czaplewski, Adam Liwo et al. · Proceedings of the National Academy of Sciences · 2005 · 146 citations