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Literature DB >> 19774578

Unmasking a third polymorph of a benchmark crystal-structure-prediction compound.

Saikat Roy¹, Adam J Matzger.

Abstract

Entities: Chemical Disease Gene Species

Mesh：

Year: 2009 PMID： 19774578 PMCID： PMC3140642 DOI： 10.1002/anie.200903285

Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN： 1433-7851 Impact factor: 15.336

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13 in total

1. The use of polymer heteronuclei for crystalline polymorph selection.

Authors: Meidong Lang; Adam L Grzesiak; Adam J Matzger
Journal: J Am Chem Soc Date: 2002-12-18 Impact factor: 15.419

2. Crystal structure prediction of small organic molecules: a second blind test.

Authors: W D Sam Motherwell; Herman L Ammon; Jack D Dunitz; Alexander Dzyabchenko; Peter Erk; Angelo Gavezzotti; Detlef W M Hofmann; Frank J J Leusen; Jos P M Lommerse; Wijnand T M Mooij; Sarah L Price; Harold Scheraga; Bernd Schweizer; Martin U Schmidt; Bouke P van Eijck; Paul Verwer; Donald E Williams
Journal: Acta Crystallogr B Date: 2002-07-30

3. Polymorphism in benzamide.

Authors: W I F David; K Shankland; C R Pulham; N Blagden; R J Davey; M Song
Journal: Angew Chem Int Ed Engl Date: 2005-11-04 Impact factor: 15.336

4. A third blind test of crystal structure prediction.

Authors: G M Day; W D S Motherwell; H L Ammon; S X M Boerrigter; R G Della Valle; E Venuti; A Dzyabchenko; J D Dunitz; B Schweizer; B P van Eijck; P Erk; J C Facelli; V E Bazterra; M B Ferraro; D W M Hofmann; F J J Leusen; C Liang; C C Pantelides; P G Karamertzanis; S L Price; T C Lewis; H Nowell; A Torrisi; H A Scheraga; Y A Arnautova; M U Schmidt; P Verwer
Journal: Acta Crystallogr B Date: 2005-09-23

5. A major advance in crystal structure prediction.

Authors: Marcus A Neumann; Frank J J Leusen; John Kendrick
Journal: Angew Chem Int Ed Engl Date: 2008 Impact factor: 15.336

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

Authors: Graeme M Day; Timothy G Cooper; Aurora J Cruz-Cabeza; Katarzyna E Hejczyk; Herman L Ammon; Stephan X M Boerrigter; Jeffrey S Tan; Raffaele G Della Valle; Elisabetta Venuti; Jovan Jose; Shridhar R Gadre; Gautam R Desiraju; Tejender S Thakur; Bouke P van Eijck; Julio C Facelli; Victor E Bazterra; Marta B Ferraro; Detlef W M Hofmann; Marcus A Neumann; Frank J J Leusen; John Kendrick; Sarah L Price; Alston J Misquitta; Panagiotis G Karamertzanis; Gareth W A Welch; Harold A Scheraga; Yelena A Arnautova; Martin U Schmidt; Jacco van de Streek; Alexandra K Wolf; Bernd Schweizer
Journal: Acta Crystallogr B Date: 2009-03-16

2. Combinatorial selection of molecular conformations and supramolecular synthons in quercetin cocrystal landscapes: a route to ternary solids.

Authors: Ritesh Dubey; Gautam R Desiraju
Journal: IUCrJ Date: 2015-06-11 Impact factor: 4.769

2 in total

Unmasking a third polymorph of a benchmark crystal-structure-prediction compound.

1. The use of polymer heteronuclei for crystalline polymorph selection.

2. Crystal structure prediction of small organic molecules: a second blind test.

3. Polymorphism in benzamide.

4. A third blind test of crystal structure prediction.

5. A major advance in crystal structure prediction.

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

7. Selection and discovery of polymorphs of platinum complexes facilitated by polymer-induced heteronucleation.

8. Crystalline polymorph selection and discovery with polymer heteronuclei.

9. Conformational polymorphism in organic crystals.

10. New form discovery for the analgesics flurbiprofen and sulindac facilitated by polymer-induced heteronucleation.

1. Activating efficient phosphorescence from purely organic materials by crystal design.

2. Combinatorial selection of molecular conformations and supramolecular synthons in quercetin cocrystal landscapes: a route to ternary solids.