Parameterization of the close packing of molecules in the unit cellPIDCOCK, Elna; MOTHERWELL, W. D.Acta crystallographica. Section B, Structural science. 2004, Vol 60, Num 6, pp 725-733, issn 0108-7681, 9 p.Article

A novel description of the crystal packing of moleculesPIDCOCK, Elna; MOTHERWELL, W. D.Crystal growth & design. 2004, Vol 4, Num 3, pp 611-620, issn 1528-7483, 10 p.Article

CATS ― a machine independent on-line catalogue systemMOTHERWELL, W. D. S.VINE. Very informal newsletter on library automation. 1986, Num 63, pp 21-25, issn 0305-5728Article

Distribution of molecular centres in unit cells with respect to packing patternsPIDCOCK, Eina; MOTHERWELL, W. D.Acta crystallographica. Section B, Structural science. 2004, Vol 60, Num 5, pp 539-546, issn 0108-7681, 8 p.Article

Distribution of molecular centres in crystallographic unit cellsMOTHERWELL, W. D. S.Acta crystallographica. Section B, Structural science. 1997, Vol 53, Num 4, pp 726-736, issn 0108-7681Article

Effect of intermolecular hydrogen-bonded motifs on packing pattern populationsPIDCOCK, Elna; MOTHERWELL, W. D.Crystal growth & design. 2005, Vol 5, Num 6, pp 2322-2330, issn 1528-7483, 9 p.Article

Hydrogen bond competition between chemical groups: new methodology and the Cambridge Structural Database : Future of structural chemistryINFANTES, Lourdes; MOTHERWELL, W. D.Zeitschrift für Kristallographie. 2005, Vol 220, Num 4, pp 333-339, issn 0044-2968, 7 p.Article

Beyond the isotropic atom model in crystal structure prediction of rigid molecules: Atomic multipoles versus point chargesDAY, Graeme M; MOTHERWELL, W. D; JONES, William et al.Crystal growth & design. 2005, Vol 5, Num 3, pp 1023-1033, issn 1528-7483, 11 p.Article

Crystal structure prediction and the Cambridge structural databaseMOTHERWELL, W. D. S.Molecular crystals and liquid crystals science and technology. Section A, Molecular crystals and liquid crystals. 2001, Vol 356, pp 559-567, issn 1058-725XConference Paper

Pharmaceutical cocrystallization: Engineering a remedy for caffeine hydrationTRASK, Andrew V; MOTHERWELL, W. D; JONES, William et al.Crystal growth & design. 2005, Vol 5, Num 3, pp 1013-1021, issn 1528-7483, 9 p.Article

A database survey of molecular and crystallographic symmetryPIDCOCK, Elna; MOTHERWELL, W. D; COLE, Jason C et al.Acta crystallographica. Section B, Structural science. 2003, Vol 59, Num 5, pp 634-640, issn 0108-7681, 7 p.Article

Applications of the Cambridge Structural Database in organic chemistry and crystal chemistryALLEN, Frank H; MOTHERWELL, W. D.Acta crystallographica. Section B, Structural science. 2002, Vol 58, Num 3, pp 407-422, issn 0108-7681, 1Article

General method for the description, visualization and comparison of metal coordination spheres : geometrical preferences, deformations and interconversion pathwaysJING WEN YAO; COPLEY, Royston C. B; HOWARD, Judith A. K et al.Acta crystallographica. Section B, Structural science. 2001, Vol 57, Num 3, pp 251-260, issn 0108-7681Article

A strategy for predicting the crystal structures of flexible molecules : the polymorphism of phenobarbitalDAY, G. M; MOTHERWELL, W. D. S; JONES, W et al.PCCP. Physical chemistry chemical physics (Print). 2007, Vol 9, Num 14, pp 1693-1704, issn 1463-9076, 12 p.Article

Physical stability enhancement of theophylline via cocrystallizationTRASK, Andrew V; MOTHERWELL, W. D. Sam; JONES, William et al.International journal of pharmaceutics. 2006, Vol 320, Num 1-2, pp 114-123, issn 0378-5173, 10 p.Article

Graph-set and packing analysis of hydrogen-bonded networks in polyamide structures in the Cambridge structural databaseMOTHERWELL, W. D; SHIELDS, Gregory P; ALLEN, Frank H et al.Acta crystallographica. Section B, Structural science. 2000, Vol 56, Num 5, pp 857-871, issn 0108-7681Article

Formation of quinol co-crystals with hydrogen-bond acceptorsOSWALD, Lain D. H; MOTHERWELL, W. D; PARSONS, Simon et al.Acta crystallographica. Section B, Structural science. 2005, Vol 61, Num 1, pp 46-57, issn 0108-7681, 12 p.Article

Influence of dicarboxylic acid structure on tape networks in co-crystals of 2-pyridoneEDWARDS, M. R; JONES, W; MOTHERWELL, W. D. S et al.Crystal engineering. 2002, Vol 5, Num 1, pp 25-36, issn 1463-0184Article

Pharmaceutical cocrystals : An emerging approach to physical property enhancementJONES, William; MOTHERWELL, W. D. Samuel; TRASK, Andrew V et al.MRS bulletin. 2006, Vol 31, Num 11, pp 875-879, issn 0883-7694, 5 p.Article

Automated assignment of graph-set descriptors for crystallographically symmetric moleculesMOTHERWELL, W. D. S; SHIELDS, G. P; ALLEN, F. H et al.Acta crystallographica. Section B, Structural science. 2000, Vol 56, Num 3, pp 466-473, issn 0108-7681Article

Visualization and characterization of non-covalent networks in molecular crystals : automated assignment of graph-set descriptors for asymmetric moleculesMOTHERWELL, W. D. S; SHIELDS, G. P; ALLEN, F. H et al.Acta crystallographica. Section B, Structural science. 1999, Vol 55, Num 6, pp 1044-1056, issn 0108-7681Article

Realizing predicted Crystal structures at extreme conditions: The low-temperature and high-pressure crystal structures of 2-chlorophenol and 4-fluorophenolOSWALD, Iain D. H; ALLAN, David R; DAY, Graeme M et al.Crystal growth & design. 2005, Vol 5, Num 3, pp 1055-1071, issn 1528-7483, 17 p.Article

Report of the working group on crystal phase identifiersBROWN, I. David; ABRAHAMS, Sidney C; BERNDT, Michael et al.Acta crystallographica. Section A, Foundations of crystallography. 2005, Vol 61, pp 575-580, issn 0108-7673, 6 p., 6Article

The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptorsOSWALD, Lain D. H; ALLAN, David R; MCGREGOR, Pamela A et al.Acta crystallographica. Section B, Structural science. 2002, Vol 58, Num 6, pp 1057-1066, issn 0108-7681, 10 p.Article

CSDsymmetry: the definitive database of point-group and space-group symmetry relationships in small-molecule crystal structuresJING WEN YAO; COLE, Jason C; PIDCOCK, Elna et al.Acta crystallographica. Section B, Structural science. 2002, Vol 58, Num 4, pp 640-646, issn 0108-7681Article