METRC Publications – 6 January 2010

Crystal Structure Prediction

Crystal Structure Prediction

The latest papers from the METRC academic members.

Thermal Degradation of Electroplated Nickel Thermal Microactuators
Luo, JK; Fu, YQ; Williams, JA; et al.
JOURNAL OF MICROELECTROMECHANICAL SYSTEMS 18 (6): 1279-1287 2009, Link

Revisiting the Blind Tests in Crystal Structure Prediction: Accurate Energy Ranking of Molecular Crystals
Asmadi, A; Neumann, MA; Kendrick, J; et al.
JOURNAL OF PHYSICAL CHEMISTRY B 113 (51): 16303-16313 2009, Link

Rheological Investigation of Self-emulsification Process: Effect of Co-surfactant

Biradar, SV; Dhumal, RS; Paradkar, A

JOURNAL OF PHARMACY AND PHARMACEUTICAL SCIENCES 12 (2): 164-174 2009

Heparin functionalisation of porous PLGA scaffolds for controlled, biologically relevant delivery of growth factors for soft tissue engineering
Rohman, G; Baker, SC; Southgate, J; et al.
JOURNAL OF MATERIALS CHEMISTRY 19 (48): 9265-9273 2009, Link

The influence of an alkenyl terminal group on the mesomorphic behaviour and electro-optic properties of fluorinated terphenyl liquid crystals
Gasowska, JS; Cowling, SJ; Cockett, MCR; et al.
JOURNAL OF MATERIALS CHEMISTRY 20 (2): 299-307 2010, Link

Impact of Surface Tension and Viscosity on Solids Motion in a Conical High Shear Mixer Granulator
Fan, XF; Yang, ZF; Parker, DJ; et al.
AICHE JOURNAL 55 (12): 3088-3098 2009, Link

A benchmark study on the thermal conductivity of nanofluids
Buongiorno, J; Venerus, DC; Prabhat, N; et al.
JOURNAL OF APPLIED PHYSICS 106 (9): Art. No. 094312 2009, Link

Surface influenced magnetostructural transition in FeRh films
Kim, JW; Ryan, PJ; Ding, Y; et al.
APPLIED PHYSICS LETTERS 95 (22): Art. No. 222515  2009, Link

Real-time vapour sensing using an OFET-based electronic nose and genetic programming
Wedge, DC; Das, A; Dost, R; et al.
SENSORS AND ACTUATORS B-CHEMICAL 143 (1): 365-372 2009, Link

Aqueous Gels of Mixtures of Ionic Surfactant SDS with Pluronic Copolymers P123 or F127

Chaibundit, C; Ricardo, NMPS; Ricardo, NMPS; et al.
LANGMUIR 25 (24): 13776-13783 2009, Link

Phenylenevinylene Block Copolymers via Ring-Opening Metathesis Polymerization
Yu, CY; Kingsley, JW; Lidzey, DG; et al.
MACROMOLECULAR RAPID COMMUNICATIONS 30 (22): 1889-1892 2009, Link

Fabrication of poly(3-hexylthiophene) self-switching diodes using thermal nanoimprint lithography and argon milling
Kettle, J; Whitelegg, S; Song, AM; et al.
JOURNAL OF VACUUM SCIENCE & TECHNOLOGY B 27 (6): 2801-2804 2009, Link

Differential patterning of neuronal, glial and neural progenitor cells on phosphorus-doped and UV irradiated diamond-like carbon
Regan, EM; Uney, JB; Dick, AD; et al.
BIOMATERIALS 31 (2): 207-215 2010, Link

Mass spectrometry of hyper-velocity impacts of organic micrograins
Srama, R; Woiwode, W; Postberg, F; et al.
RAPID COMMUNICATIONS IN MASS SPECTROMETRY 23 (24): 3895-3906 2009, Link

Penetration of polymersome drug and gene delivery nanoparticles into in vitro models of head and neck cancer and tissue engineered oral mucosa
Hearnden, V; Battaglia, G; MacNeil, S; et al.
ORAL ONCOLOGY : 66-66 Suppl. S 2009, Link

Carbon nitride: Ab initio investigation of carbon-rich phases
Hart, JN; Claeyssens, F; Allan, NL; et al.
PHYSICAL REVIEW B 80 (17): Art. No. 174111 2009, Link

Sub-micron poly(N-isopropylacrylamide) particles as temperature responsive vehicles for the detachment and delivery of human cells
Hopkins, S; Carter, SR; Haycock, JW; et al.
SOFT MATTER 5 (24): 4928-4937 2009, Link

Halogen-Bonded Cocrystals of 4-(N,N-Dimethylamino)pyridine with Fluorinated Iodobenzenes
Prasang, C; Whitwood, AC; Bruce, DW
CRYSTAL GROWTH & DESIGN 9 (12): 5319-5326  2009, Link

The Derivatization of Bioplatform Molecules by using KF/Alumina Catalysis
Clark, JH; Farmer, TJ; Macquarrie, DJ
CHEMSUSCHEM 2 (11): 1025-1027 2009

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