Dynamic PCA-based MSPC charts for nucleation prediction in batch cooling crystallization processes

[1]  J. Mullin,et al.  Evidence of molecular cluster formation in supersaturated solutions of citric acid , 1969 .

[2]  J. Garside,et al.  Solute clustering in supersaturated solutions , 1986 .

[3]  A. Myerson,et al.  Diffusion and cluster formation in supersaturated solutions , 1990 .

[4]  H. R. Keller,et al.  Evolving factor analysis , 1991 .

[5]  J. E. Jackson A User's Guide to Principal Components , 1991 .

[6]  Comparison of Noniterative Factor Analysis Spectral Resolution Algorithms , 1993 .

[7]  Romà Tauler,et al.  Simultaneous analysis of several spectroscopic titrations with self-modelling curve resolution , 1993 .

[8]  Spectroscopic monitoring of environmentally benign anti-solvent crystallization , 1996 .

[9]  D. Massart,et al.  Orthogonal projection approach applied to peak purity assessment. , 1996, Analytical chemistry.

[10]  A. Mersmann Supersaturation and Nucleation , 1996 .

[11]  R. Docherty,et al.  Polymorphism in Molecular Crystals: Stabilization of a Metastable Form by Conformational Mimicry , 1997 .

[12]  Dilum D. Dunuwila,et al.  ATR FTIR spectroscopy for in situ measurement of supersaturation , 1997 .

[13]  Peter de B. Harrington,et al.  Interactive Self-Modeling Mixture Analysis of Ion Mobility Spectra , 1997 .

[14]  Desire L. Massart,et al.  Resolution of multicomponent overlapped peaks by the orthogonal projection approach, evolving factor analysis and window factor analysis , 1997 .

[15]  S. Šašić Quantitative analysis of overlapped Raman spectra by target factor analysis and evolving factor analysis , 1998 .

[16]  Age K. Smilde,et al.  Application of curve resolution based methods to kinetic data , 1999 .

[17]  D. Massart,et al.  On-line application of the orthogonal projection approach (OPA) and the soft independent modelling of class analogy approach (SIMCA) for the detection of the end point of a polymorph conversion reaction by near infrared spectroscopy (NIR) , 1999 .

[18]  A. Smilde,et al.  Estimating reaction rate constants: comparison between traditional curve fitting and curve resolution , 2000 .

[19]  Chris W. Brown,et al.  Self-Modeling Mixture Analysis by Interactive Principal Component Analysis , 2000 .

[20]  D. Massart,et al.  Determination of the End Point of a Chemical Synthesis Process Using On-Line Measured Mid-Infrared Spectra , 2000 .

[21]  J. R. Torres-Lapasió,et al.  Resolution of multicomponent peaks by orthogonal projection approach, positive matrix factorization and alternating least squares , 2000 .

[22]  George Zhou,et al.  A simple quantitative FT-IR approach for the study of a polymorphic transformation under crystallization slurry conditions. , 2001, Journal of pharmaceutical and biomedical analysis.

[23]  J. Anderson,et al.  Determination of the onset of crystallization of N1-2-(thiazolyl)sulfanilamide (sulfathiazole) by UV-Vis and calorimetry using an automated reaction platform; subsequent characterization of polymorphic forms using dispersive Raman spectroscopy. , 2001, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

[24]  R. Davey,et al.  From Molecules to Crystallizers , 2001 .

[25]  R. Davey,et al.  Crystal Polymorphism as a Probe for Molecular Self-Assembly during Nucleation from solutions: The Case of 2,6 - Dihydroxybenzoic Acid. , 2001 .

[26]  R. Braatz,et al.  Solute concentration prediction using chemometrics and ATR-FTIR spectroscopy , 2001 .

[27]  Yann Batonneau,et al.  Combined use of conventional and second-derivative data in the SIMPLISMA self-modeling mixture analysis approach. , 2002, Analytical chemistry.

[28]  K. Berglund,et al.  ATR-FTIR for Determining Optimal Cooling Curves for Batch Crystallization of Succinic Acid , 2002 .

[29]  Veronica M. Profir,et al.  Study of the Crystallization of Mandelic Acid in Water Using in Situ ATR−IR Spectroscopy , 2002 .

[30]  J. Ulrich,et al.  Some aspects of the importance of metastable zone width and nucleation in industrial crystallizers , 2002 .

[31]  F. Puel,et al.  Real-time evaluation of the concentration of impurities during organic solution crystallization , 2003 .

[32]  B. Glennon,et al.  In Situ Monitoring of Polymorphic Transitions , 2003 .

[33]  K. Roberts,et al.  In-Process ATR-FTIR Spectroscopy for Closed-Loop Supersaturation Control of a Batch Crystallizer Producing Monosodium Glutamate Crystals of Defined Size , 2003 .

[34]  Peter York,et al.  Use of in situ FT-Raman spectroscopy to study the kinetics of the transformation of carbamazepine polymorphs. , 2004, Journal of pharmaceutical and biomedical analysis.

[35]  J. H. T. Horst,et al.  Quantitative Measurement of the Polymorphic Transformation of l-Glutamic Acid Using In-Situ Raman Spectroscopy , 2004 .

[36]  Lawrence X. Yu,et al.  Applications of process analytical technology to crystallization processes. , 2004, Advanced drug delivery reviews.

[37]  Kati Pöllänen,et al.  Batch cooling crystallization study based on in-line measurement of supersaturation and crystal size distribution , 2005 .

[38]  Jukka Rantanen,et al.  IR spectroscopy together with multivariate data analysis as a process analytical tool for in-line monitoring of crystallization process and solid-state analysis of crystalline product. , 2005, Journal of pharmaceutical and biomedical analysis.

[39]  Lars Nyström,et al.  ATR-FTIR in monitoring of crystallization processes: comparison of indirect and direct OSC methods , 2005 .