Roberts KJ - Search Results

1

Formulation pre-screening of inhalation powders using computational atom-atom systematic search method.

Ramachandran V, Murnane D, Hammond RB, Pickering J, Roberts KJ, Soufian M, Forbes B, Jaffari S, Martin GP, Collins E, Pencheva K. Ramachandran V, et al. Among authors: roberts kj. Mol Pharm. 2015 Jan 5;12(1):18-33. doi: 10.1021/mp500335w. Epub 2014 Nov 24. Mol Pharm. 2015. PMID: 25380027 Free article.

2

Refinement of hydrogen atomic position in a hydrogen bond using a combination of solid-state NMR and computation.

Harris RK, Ghi PY, Hammond RB, Ma CY, Roberts KJ. Harris RK, et al. Among authors: roberts kj. Chem Commun (Camb). 2003 Nov 21;(22):2834-5. doi: 10.1039/b309302f. Chem Commun (Camb). 2003. PMID: 14651128

3

Enhancing the signal-to-noise ratio of X-ray diffraction profiles by smoothed principal component analysis.

Chen ZP, Morris J, Martin E, Hammond RB, Lai X, Ma C, Purba E, Roberts KJ, Bytheway R. Chen ZP, et al. Among authors: roberts kj. Anal Chem. 2005 Oct 15;77(20):6563-70. doi: 10.1021/ac050616c. Anal Chem. 2005. PMID: 16223241

4

Simulation of energetic stability of facetted l-glutamic acid nanocrystalline clusters in relation to their polymorphic phase stability as a function of crystal size.

Hammond RB, Pencheva K, Roberts KJ. Hammond RB, et al. Among authors: roberts kj. J Phys Chem B. 2005 Oct 27;109(42):19550-2. doi: 10.1021/jp053546m. J Phys Chem B. 2005. PMID: 16853527

5

Grid-based molecular modeling for pharmaceutical salt screening: Case example of 3,4,6,7,8,9-hexahydro-2H-pyrimido (1,2-a) pyrimidinium acetate.

Hammond RB, Hashim RS, Ma C, Roberts KJ. Hammond RB, et al. Among authors: roberts kj. J Pharm Sci. 2006 Nov;95(11):2361-72. doi: 10.1002/jps.20657. J Pharm Sci. 2006. PMID: 16886182

6

Quantifying solubility enhancement due to particle size reduction and crystal habit modification: case study of acetyl salicylic acid.

Hammond RB, Pencheva K, Roberts KJ, Auffret T. Hammond RB, et al. Among authors: roberts kj. J Pharm Sci. 2007 Aug;96(8):1967-73. doi: 10.1002/jps.20869. J Pharm Sci. 2007. PMID: 17323349

7

An examination of polymorphic stability and molecular conformational flexibility as a function of crystal size associated with the nucleation and growth of benzophenone.

Hammond RB, Pencheva K, Roberts KJ. Hammond RB, et al. Among authors: roberts kj. Faraday Discuss. 2007;136:91-106; discussion 107-23. doi: 10.1039/b616757h. Faraday Discuss. 2007. PMID: 17955805

8

An examination of binding motifs associated with inter-particle interactions between facetted nano-crystals of acetylsalicylic acid and ascorbic acid through the application of molecular grid-based search methods.

Hammond RB, Jeck S, Ma CY, Pencheva K, Roberts KJ, Auffret T. Hammond RB, et al. Among authors: roberts kj. J Pharm Sci. 2009 Dec;98(12):4589-602. doi: 10.1002/jps.21758. J Pharm Sci. 2009. PMID: 19544525

9

Dependence of the critical undercooling for crystallization on the cooling rate.

Kashchiev D, Borissova A, Hammond RB, Roberts KJ. Kashchiev D, et al. Among authors: roberts kj. J Phys Chem B. 2010 Apr 29;114(16):5441-6. doi: 10.1021/jp100202m. J Phys Chem B. 2010. PMID: 20369862

10

Towards an understanding of the nucleation of alpha-para amino benzoic acid from ethanolic solutions: a multi-scale approach.

Toroz D, Rosbottom I, Turner TD, Corzo DM, Hammond RB, Lai X, Roberts KJ. Toroz D, et al. Among authors: roberts kj. Faraday Discuss. 2015;179:79-114. doi: 10.1039/c4fd00275j. Epub 2015 Apr 29. Faraday Discuss. 2015. PMID: 25920721 Free article.

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