Crystal structure prediction of organic pigments: quinacridone as an example.

Autor: Panina, N.¹, Leusen, F. J. J.², Janssen, F. F. B. J.¹, Verwer, P.³, Meekes, H.¹ hugo.meekes@science.ru.nl, Vlieg, E.¹, Deroover, G.⁴

Publikováno v: Journal of Applied Crystallography. Feb2007, Vol. 40 Issue 1, p105-114. 10p. 13 Diagrams, 2 Charts.

Structures of a pair of diastereomeric salts of ephedrine and bromo-substituted cyclic phosphoric acid.

Autor: Bruins Slot, H. J., Leusen, F. J. J., Van Der Haest, A. D., Smits, J. M. M.

Publikováno v: Acta Crystallographica: Section C (Wiley-Blackwell); Feb1992, Vol. 48 Issue 2, p372-376, 5p

A third blind test of crystal structure prediction.

Autor: Day, G. M., Motherwell, W. D. S., Ammon, H. L., Boerrigter, S. X. M., Della Valle, R. G., Venuti, E., Dzyabchenko, A., Dunitz, J. D., Schweizer, B., van Eijck, B. P., Erk, P., Facelli, J. C., Bazterra, V. E., Ferraro, M. B., Hofmann, D. W. M., Leusen, F. J. J., Liang, C., Pantelides, C. C., Karamertzanis, P. G., Price, S. L.

Publikováno v: Acta Crystallographica: Section B (Wiley-Blackwell); Oct2005, Vol. 61 Issue 5, p511-527, 17p, 7 Diagrams, 7 Charts

A Simulated Annealing Approach for Crystal Structure Solution from Powder Diffraction Data.

Autor: Engel, G. E., Wilke, S., Harris, K. D. M., Kariuki, B. M., Ahn, S., Leusen, F. J. J., Neumann, M. A.

Publikováno v: Molecular Crystals & Liquid Crystals Science & Technology, Section A: Molecular Crystals & Liquid Crystals; Feb2001, Vol. 356 Issue 1, p355-364, 10p

Crystal Structure Prediction of Diastereomeric Salts:  A Step toward Rationalization of Racemate Resolution

Autor: Leusen, F. J. J.

Publikováno v: Crystal Growth & Design; March 2003, Vol. 3 Issue: 2 p189-192, 4p