Price SL - Search Results

1

Use of Crystal Structure Informatics for Defining the Conformational Space Needed for Predicting Crystal Structures of Pharmaceutical Molecules.

Iuzzolino L, Reilly AM, McCabe P, Price SL. Iuzzolino L, et al. Among authors: price sl. J Chem Theory Comput. 2017 Oct 10;13(10):5163-5171. doi: 10.1021/acs.jctc.7b00623. Epub 2017 Sep 25. J Chem Theory Comput. 2017. PMID: 28892623

2

The prediction, morphology, and mechanical properties of the polymorphs of paracetamol.

Beyer T, Day GM, Price SL. Beyer T, et al. Among authors: price sl. J Am Chem Soc. 2001 May 30;123(21):5086-94. doi: 10.1021/ja0102787. J Am Chem Soc. 2001. PMID: 11457339

3

The computational prediction of pharmaceutical crystal structures and polymorphism.

Price SL. Price SL. Adv Drug Deliv Rev. 2004 Feb 23;56(3):301-19. doi: 10.1016/j.addr.2003.10.006. Adv Drug Deliv Rev. 2004. PMID: 14962583 Review.

4

A third blind test of crystal structure prediction.

Day GM, Motherwell WD, Ammon HL, Boerrigter SX, Della Valle RG, Venuti E, Dzyabchenko A, Dunitz JD, Schweizer B, van Eijck BP, Erk P, Facelli JC, Bazterra VE, Ferraro MB, Hofmann DW, Leusen FJ, Liang C, Pantelides CC, Karamertzanis PG, Price SL, Lewis TC, Nowell H, Torrisi A, Scheraga HA, Arnautova YA, Schmidt MU, Verwer P. Day GM, et al. Among authors: price sl. Acta Crystallogr B. 2005 Oct;61(Pt 5):511-27. doi: 10.1107/S0108768105016563. Epub 2005 Sep 23. Acta Crystallogr B. 2005. PMID: 16186652

5

Validation of a search technique for crystal structure prediction of flexible molecules by application to piracetam.

Nowell H, Price SL. Nowell H, et al. Among authors: price sl. Acta Crystallogr B. 2005 Oct;61(Pt 5):558-68. doi: 10.1107/S0108768105018549. Epub 2005 Sep 23. Acta Crystallogr B. 2005. PMID: 16186656

6

Challenges of crystal structure prediction of diastereomeric salt pairs.

Karamertzanis PG, Price SL. Karamertzanis PG, et al. Among authors: price sl. J Phys Chem B. 2005 Sep 15;109(36):17134-50. doi: 10.1021/jp052465n. J Phys Chem B. 2005. PMID: 16853186

7

Modeling the interplay of inter- and intramolecular hydrogen bonding in conformational polymorphs.

Karamertzanis PG, Day GM, Welch GW, Kendrick J, Leusen FJ, Neumann MA, Price SL. Karamertzanis PG, et al. Among authors: price sl. J Chem Phys. 2008 Jun 28;128(24):244708. doi: 10.1063/1.2937446. J Chem Phys. 2008. PMID: 18601366

8

From crystal structure prediction to polymorph prediction: interpreting the crystal energy landscape.

Price SL. Price SL. Phys Chem Chem Phys. 2008 Apr 21;10(15):1996-2009. doi: 10.1039/b719351c. Epub 2008 Feb 19. Phys Chem Chem Phys. 2008. PMID: 18688351 Review.

9

Significant progress in predicting the crystal structures of small organic molecules--a report on the fourth blind test.

Day GM, Cooper TG, Cruz-Cabeza AJ, Hejczyk KE, Ammon HL, Boerrigter SX, Tan JS, Della Valle RG, Venuti E, Jose J, Gadre SR, Desiraju GR, Thakur TS, van Eijck BP, Facelli JC, Bazterra VE, Ferraro MB, Hofmann DW, Neumann MA, Leusen FJ, Kendrick J, Price SL, Misquitta AJ, Karamertzanis PG, Welch GW, Scheraga HA, Arnautova YA, Schmidt MU, van de Streek J, Wolf AK, Schweizer B. Day GM, et al. Among authors: price sl. Acta Crystallogr B. 2009 Apr;65(Pt 2):107-25. doi: 10.1107/S0108768109004066. Epub 2009 Mar 16. Acta Crystallogr B. 2009. PMID: 19299868

10

Successful prediction of a model pharmaceutical in the fifth blind test of crystal structure prediction.

Kazantsev AV, Karamertzanis PG, Adjiman CS, Pantelides CC, Price SL, Galek PT, Day GM, Cruz-Cabeza AJ. Kazantsev AV, et al. Among authors: price sl. Int J Pharm. 2011 Oct 14;418(2):168-78. doi: 10.1016/j.ijpharm.2011.03.058. Epub 2011 Apr 8. Int J Pharm. 2011. PMID: 21497184

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

166 results

Search Page

Filters