| Avogadro: An advanced semantic chemical editor, visualization, and analysis platform. MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ... J. Cheminformatics 4 (1), 17, 2012 | 9679 | 2012 |
| XtalOpt version r7: An open-source evolutionary algorithm for crystal structure prediction DC Lonie, E Zurek Computer Physics Communications 182 (10), 2305-2306, 2011 | 399* | 2011 |
| Metallization of magnesium polyhydrides under pressure DC Lonie, J Hooper, B Altintas, E Zurek Physical Review B—Condensed Matter and Materials Physics 87 (5), 054107, 2013 | 136 | 2013 |
| Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on. NM O'Boyle, R Guha, EL Willighagen, SE Adams, J Alvarsson, JC Bradley, ... J. Cheminformatics 3, 37, 2011 | 100 | 2011 |
| Identifying duplicate crystal structures: XtalComp, an open-source solution DC Lonie, E Zurek Computer Physics Communications 183 (3), 690-697, 2012 | 99 | 2012 |
| Avogadro: an advanced semantic chemical editor, visualization, and analysis platform. J Cheminform. 2012; 4: 17 MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ... | 89 | |
| Avogadro: an open-source molecular builder and visualization tool MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ... Journal of Cheminformatics 4, 17, 2012 | 40 | 2012 |
| XtalOpt version r9: An open-source evolutionary algorithm for crystal structure prediction Z Falls, DC Lonie, P Avery, A Shamp, E Zurek Computer Physics Communications 199, 178-179, 2016 | 26 | 2016 |
| A computational experiment on single-walled carbon nanotubes S Simpson, DC Lonie, J Chen, E Zurek Journal of Chemical Education 90 (5), 651-655, 2013 | 22 | 2013 |
| Determination of the structures of molecularly imprinted polymers and xerogels using an automated stochastic approach A Wach, J Chen, Z Falls, D Lonie, ER Mojica, D Aga, J Autschbach, ... Analytical chemistry 85 (18), 8577-8584, 2013 | 13 | 2013 |
| T. Van der meersch, E. Zurek and GR Hutchison MD Hanwell, DE Curtis, DC Lonie J. Cheminf 4, 1-17, 2012 | 6 | 2012 |
| Open Source Chemistry: Creating Tools for Automated Structure Prediction, Modeling, Visualization, and Analysis DC Lonie State University of New York at Buffalo, 2013 | | 2013 |
| Theoretical predictions of pressure-stabilized alkali metal polyhydrides E Zurek, D Lonie, P Baettig, J Hooper ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 242, 2011 | | 2011 |
| Open Data, Open Source, and Open Standards in Chemistry: The Blue Obelisk five years on A Lang, NM O'Boyle, R Guha, E Willighagen, S Adams, J Alvarsson, ... | | 2011 |
| Predicting the Geometries and Electronic Structures of Compressed Solids E Zurek, P Baettig, D Lonie, R Hoffmann | | |
Eva ZurekProfessor Department of ChemistryVerified email at buffalo.edu
