+++6статей благодарю sylvio & tyler111

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1. Robert J Gdanitz
Ab initio prediction of molecular crystal structures
Журнал Current Opinion in Solid State and Materials Science
1998, Volume 3, Issue 4, Pages 414-418.

DOI:

http://dx.doi.org/10.1016/S1359-0286(98)80054-5

+++2. David S. Coombes, Gursharan K. Nagi and Sarah L. Price
On the lack of hydrogen bonds in the crystal structure of alloxan
Chemical Physics Letters
1997, Volume 265, Issues 3-5, Pages 532-537.

DOI:

http://dx.doi.org/10.1016/S0009-2614(96)01475-3

+++3. A. V. Dzyabchenko, T. S. Pivina, and E. A. Arnautova
Prediction of structure and density for organic nitramines
Journal of Molecular Structure
1996, Volume 378, Issue 2, Pages 67-82.

DOI:

http://dx.doi.org/10.1016/0022-2860(95)09165-3

+++4. Robert J. Gdanitz
Prediction of molecular crystal structures by Monte Carlo simulated annealing without reference to diffraction data
Chemical Physics Letters
1992, Volume 190, Issues 3-4, Pages 391-396.

DOI:

http://dx.doi.org/10.1016/0009-2614(92)85357-G

+++5. Frank J. J. Leusen
Ab initio prediction of polymorphs
Journal of Crystal Growth
1996, Volume 166, Pages 900-903

DOI:

http://dx.doi.org/10.1016/0022-0248(96)00099-1

+++6. R. S. Payne, R. J. Roberts, R. C. Rowe and R. Docherty
Examples of successful crystal structure prediction: polymorphs of primidone and progesterone
International Journal of Pharmaceutics
1999, Volume 177, Issue 2, Pages 231-245.

DOI:

http://dx.doi.org/10.1016/S0378-5173(98)00348-2

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[sylvio]

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[tyler111]

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