Accurate charge density of α-glycine by the maximum entropy method

CrystEngComm

Volumn 10, Issue 3, 2008, Pages 335-343

  Netzel, Jeanette ^a   Hofmann, Andreas ^a   Van Smaalen, Sander ^a  

^a UNIVERSITY OF BAYREUTH   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 39749106863     PISSN: 14668033     EISSN: 14668033     Source Type: Journal    
DOI: 10.1039/b711064b     Document Type: Article

References (32)

1. R. F. W. Bader, Atoms in Molecules. Oxford University Press, Oxford, 1994
2. T. S. Koritsanszky P. Coppens Chem. Rev. 2001 101 1583 1627
3. Maximum Entropy in Action, ed., B. Buck, and, V. A. Macaulay, Clarendon Press, Oxford, 1991
4. C. J. Gilmore Acta Crystallogr., Sect. A: Found. Crystallogr. 1996 52 561 589
5. W. Jauch A. Palmer Acta Crystallogr., Sect. A: Found. Crystallogr. 1993 49 590 591
6. W. Jauch Acta Crystallogr., Sect. A: Found. Crystallogr. 1994 50 650 652
7. R. Y. de Vries W. J. Briels D. Feil Phys. Rev. Lett. 1996 77 1719 1722
8. M. Takata M. Sakata Acta Crystallogr., Sect. A: Found. Crystallogr. 1996 52 287 290
9. P. Roversi J. J. Irwin G. Bricogne Acta Crystallogr., Sect. A: Found. Crystallogr. 1998 54 971 996
10. L. Palatinus S. van Smaalen Acta Crystallogr., Sect. A: Found. Crystallogr. 2002 58 559 567
11. R. Y. de Vries W. J. Briels D. Feil Acta Crystallogr., Sect. A: Found. Crystallogr. 1994 50 383 391
12. L. Palatinus S. van Smaalen Acta Crystallogr., Sect. A: Found. Crystallogr. 2005 61 363 372
13. A. Hofmann J. Netzel S. van Smaalen Acta Crystallogr., Sect. B 2007 63 285 295
14. B. Zarychta V. Pichon-Pesme B. Guillot C. Lecomte C. Jelsch Acta Crystallogr., Sect. A: Found. Crystallogr. 2007 63 108 125
15. P. M. Dominiak A. Volkov X. Li M. Messerschmidt P. Coppens J. Chem. Theory Comput. 2007 3 232 247
16. B. Dittrich C. B. Hübschle P. Luger M. A. Spackman Acta Crystallogr., Sect. D 2006 62 1325 1335
17. S. Mebs M. Messerschmidt P. Luger Z. Kristallogr. 2006 221 656 664
18. A. Hofmann R. Kalinowski P. Luger S. van Smaalen Acta Crystallogr., Sect. B 2007 63 633 643
19. R. Destro P. Roversi M. Barzaghi R. E. Marsh J. Phys. Chem. A 2000 104 1047 1054
20. B. Bagautdinov J. Luedecke M. Schneider S. van Smaalen Acta Crystallogr., Sect. B 1998 54 626 634
21. International Tables for Crystallography, vol. C, ed., A. J. C. Wilson, Kluwer Academic Publishers, 1995
22. V. Petřiček, M. Duek and L. Palatinus, JANA 2000, The Crystallographic Computing System, Institute of Physics, Academy of Sciences of the Czech Republic, Praha, 2000
23. M. Sakata M. Sato Acta Crystallogr., Sect. A: Found. Crystallogr. 1990 46 263 270
24. S. van Smaalen L. Palatinus M. Schneider Acta Crystallogr., Sect. A: Found. Crystallogr. 2003 59 459 469
25. S. F. Gull, in Maximum Entropy and Bayesian Methods, ed., J. Skilling, Kluwer, Dordrecht, 1989, pp. 53-71
26. S. F. Gull and J. Skilling, Quantified Maximum Entropy, MEMSYS5 Users'Manual, Maximum Entropy Data Consultants Ltd., Suffolk, UK, 1999
27. A. Volkov Y. Abramov P. Coppens C. Gatti Acta Crystallogr., Sect. A: Found. Crystallogr. 2000 56 332 339
28. A. Volkov Y. Abramov P. Coppens Acta Crystallogr., Sect. A: Found. Crystallogr. 2001 57 272 282
29. A. Volkov P. Coppens Acta Crystallogr., Sect. A: Found. Crystallogr. 2001 57 395 405
30. A. O. Madsen H. O. Sorensen C. Flensburg R. F. Stewart S. Larsen Acta Crystallogr., Sect. A: Found. Crystallogr. 2004 60 550 561
31. T. Koritsanszky, In Hydrogen bonding-new insights, ed., S. J. Grabowksi, Springer, Berlin, 2006
32. E. Rödel M. Messerschmidt B. Dittrich P. Luger Org. Biomol. Chem. 2006 4 475 481