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Scientific Papers

Title Author Published Journal
QUASI: A general purpose implementation of the QM/MM approach and its application Dr John Kendrick 15/08/03 Journal of Molecular Structure - Theochem, 632, 1-28
Neural Computing in Product Formulation Prof. Ray Rowe 01/07/03 The Chemical Educator, 8, 211-218
Neural computing boosts formulation productivity Prof. Ray Rowe 01/07/03 Pharmaceutical Technology, IT Innovations
Granular compaction by molecular dynamics simulation Prof. Jamshed Anwar 05/06/03 Chemistry of Materials, 15, 3417-3420.
Calculation of the melting curve of NaCl. Prof. Jamshed Anwar 05/06/03 J Chem. Phys., 118, 72 (2003)
Molecular dynamics simulation of compaction of powders Prof. Jamshed Anwar 08/03/03 Journal of Chemical Physics, 118(10) 4636-4648 (2003)
Crystal structure prediction of diastereomeric salts: .. racement solution Dr Frank Leusen 01/03/03 Crystal Growth & Design, 3, 189-192 (2003)
Effect of varying optimization parameters on optimization .... tablet film coat as an example formul Prof. Ray Rowe 01/03/03 European Journal of Pharmaceutical Sciences, 18(3-4)-266 (2003)
Calculation of the melting point of NaCl by molecular simulation Prof. Jamshed Anwar 08/01/03 Journal of Chemical Physics, 118(2), 728-735
The effect of experimental design on the modeling of a tablet coating formulation using ANN Prof. Ray Rowe 01/09/02 European Journal of Pharmaceutical Sciences, 16, 281-288 (2002)

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