Computers & Chemical Engineering

Computers & Chemical Engineering, Vol.22, No.S Entire volume, number list

ISSN: 0098-1354 (Print)

In this Issue (185 articles)

3 - 10	Protein folding and peptide docking : A molecular modeling and global optimization approach Klepeis JL, Ierapetritou MG, Floudas CA
11 - 18	Molecular design synthesis using stochastic optimisation as a tool for scoping and screening Marcoulaki EC, Kokossis AC
17 - 17	European Symposium on Computer Aided Process Engineering - ESCAPE-8 - Proceedings of the European Symposium, Brugge, Belgium, May 24-27, 1998 - Supplement to Computers and Chemical Engineering - Introduction Froment GF, Kalitventzeff B
19 - 26	A molecular dynamics study of intermolecular structure, thermodynamics and miscibility in hydrocarbon polymers Maranas JK, Mondello M, Grest GS, Kumar S, Debenedetti PG, Graessley WW
27 - 33	Molecular dynamics methodology for the study of the solvent effects on a concentrated Diels-Alder reaction and the separation of the post-reaction mixture Sheehan ME, Sharratt PN
37 - 44	Understanding the dynamics of a batch distillation column with a middle vessel Barolo M, Guarise GB, Rienzi SA, Trotta A
45 - 52	Simulation and optimisation of a rapid pressure swing reactor Cheng YS, Alpay E, Kershenbaum LS
53 - 60	Recovery of carotenoids from palm oil by molecular distillation Batistella CB, Maciel MRW
61 - 68	Computation of heteroazeotropes Tolsma JE, Barton PI
69 - 76	On the design of multicomponent batch distillation columns Sharif M, Shah N, Pantelides CC
77 - 84	An automated procedure for multicomponent product separation synthesis McCarthy E, Fraga ES, Ponton JW
87 - 94	Development of a process model for a batch reactive distillation - A case study Bollyn MP, Wright AR
95 - 102	Application and validation of the pseudo-kinetic rate constant method to high pressure LDPE tubular reactors Baltsas A, Papadopoulos E, Kiparissides C
103 - 110	A hybrid genetic algorithm for the estimation of parameters in detailed kinetic models Park TY, Froment GF
111 - 118	Modeling of a reactive separation process using a nonequilibrium stage model Higler A, Taylor R, Krishna R
119 - 126	New generation tools for multiphase reaction systems : A validated systematic methodology for novelty and design automation Mehta VL, Kokossis A
127 - 134	The effect of the mean particle size on the dynamic behaviour of catalyzed olefin polymerization fluidized bed reactors Hatzantonis H, Kiparissides C
137 - 140	Simulation of process chains and recycling strategies for carbon based materials using a conventional process simulator Radgen P, Pedernera EJ, Patel M, Reimert R
141 - 148	Heat integration aspects in a crude preheat refinery section Papalexandri KP, Patsiatzis DI, Pistikopoulos EN, Ebbesen L
149 - 156	Process integration : Selection of the optimal utility system. Marechal F, Kalitventzeff B
157 - 164	A rigorous disjunctive optimization model for simultaneous flowsheet optimization and heat integration Grossmann IE, Yeomans H, Kravanja Z
167 - 174	Robust optimal fermentation operating policies Uesbeck F, Samsatli NJ, Papageorgiou LG, Shah N
175 - 182	Conceptual optimisation of utility networks using hardware and comprehensive hardware composites Strouvalis AM, Mavromatis SP, Kokossis AC
183 - 190	Dynamic optimization of hybrid systems Galan S, Barton PI
191 - 198	One-layer real time optimization of LPG production in the FCC unit : procedure, advantages and disadvantages de Gouvea MT, Odloak D
199 - 204	Interior Point techniques for the Constrained Simulation Problem Kyriakopoulou DJ, Kalitventzeff B
205 - 212	Parametric optimization of MILP programs and a framework for the parametric optimization of MINLPs Pertsinidis A, Grossmann IE, McRae GJ
213 - 220	Parameter estimation in nonlinear algebraic models via global optimization Esposito WR, Floudas CA
221 - 228	Modelling and optimisation of general hybrid systems in the continuous time domain Avraam MP, Shah N, Pantelides CC
229 - 236	Total process optimization in chemical engineering with evolutionary algorithms Gross B, Roosen P
239 - 246	Application of CAPE techniques to the revamping of existing electrical power plants : an example of interdisciplinary collaboration. Heyen G, Vrielynck B, Kalitventzeff B
247 - 254	Hierarchical on-line data reconciliation and optimization for an industrial utility plant Lee MH, Lee SJ, Han CH, Chang KS, Kim SH, You SH
255 - 262	Simple and robust design of chemical plants Koolen JLA
263 - 270	An approach to management of Multilevel Distribution Systems for consumer goods and chemicals industry under information uncertainty Tahmassebi T
271 - 277	Integrated on line production and financial scheduling with intelligent autonomous agent based information system Badell M, Nougues JM, Puigjaner L
279 - 282	Analysis and design of paint manufacturing processes Rotstein G, Shah N, Sorensen E, Macchietto S, Weiss RA
285 - 292	CFD modelling of heat transfer during gas phase olefin polymerisation McKenna TF, Cokljat D, Wild P
293 - 298	CFD modelling of turbulent macromixing in stirred tanks. Effect of the probe size and number on mixing indices. Jaworski Z, Dudczak J
299 - 306	Eulerian simulations of bubbling behaviour in gas-solid fluidised beds van Wachem BGM, Schouten JC, Krishna R, van den Bleek CM
307 - 314	A model based on average velocity for gas production pipes simulation Vazquez-Roman R
315 - 322	Use of CFD in prediction of particle size distribution in suspension polymer reactors Maggioris D, Goulas A, Alexopoulos AH, Chatzi EG, Kiparissides C
323 - 328	Numerical model of a mixed flow coupled with mass and heat transfer in continuous-flow electrophoresis Afonso JL, Clifton MJ
331 - 338	Modelling and simulation of complex plate heat exchanger arrangements under milk fouling Georgiadis MC, Rotstein GE, Macchietto S
339 - 346	Optimization of wastewater treatment facilities using process simulation Petrides D, Cruz R, Calandranis J
347 - 353	Identification of parametric models based on RTD theory - Application to safety studies in ventilated nuclear enclosures Laquerbe C, Laborde JC, Floquet P, Pibouleau L, Domenech S
355 - 362	Towards on-scale crystalliser design using compartmental models Bermingham SK, Kramer HJM, van Rosmalen GM
363 - 370	A generalized reactive separation unit model. Modelling and simulation aspects Gani R, Jepsen TS, Perez-Cisneros ES
371 - 378	Dynamic catalytic distillation : Advanced simulation and experimental validation Kreul LU, Gorak A, Dittrich C, Barton PI
379 - 386	Maxwell-Stefan approach coupled with drop population model for the dynamic simulation of liquid-liquid extraction pulsed column Toutain J, Le Lann JM, Gourdon C, Joulia X
389 - 393	Operating an ideal heat integrated distillation column with different control algorithms Nakaiwa M, Huang K, Owa M, Akiya T, Nakane T, Takamatsu T
395 - 402	General approach and tool for the scheduling of complex production systems Graells M, Canton J, Peschaud B, Puigjaner L
403 - 410	Improving the efficiency of discrete time scheduling formulation Yee KL, Shah N
411 - 418	Modelling issues for control structure selection in a chemical process Cao Y, Rossiter D, Edwards DW, Knechtel J, Owens D
419 - 426	Short-term scheduling : New mathematical models vs algorithmic improvements Ierapetritou MG, Floudas CA
427 - 434	Process control for energy integrated distillation schemes Mizsey P, Hau NT, Benko N, Kalmar I, Fonyo Z
435 - 442	Optimal implementation of on-line optimization Chen XY, Pike RW, Hertwig TA, Hopper JR
443 - 449	A combined hardware/software sensing approach for on-line control of emulsion polymerisation processes Fevotte G, McKenna TF, Othman S, Santos AM
451 - 457	Robust nonlinear control of polymethylmethacrylate production in a batch reactor Sampath V, Palanki S, Cockburn JC
459 - 466	l(1)-optimal regulation of a pH control plant Tadeo F, Holohan A, Vega P
467 - 474	Multimodel robust control applied to a pH neutralization process Nystrom RH, Sandstrom KV, Gustafsson TK, Toivonen HT
475 - 482	Results diagnosis for real-time process operations optimization Miletic IP, Marlin TE
483 - 490	Life cycle hazard analysis for computer controlled processes Yang SH, Chung PWH
491 - 496	Identification of trends in process measurements using the wavelet transform Flehmig F, Von Watzdorf R, Marquardt W
499 - 504	Conceptual plant layout Schmidt-Traub H, Koster M, Holtkotter T, Nipper N
505 - 511	A mixed method for retrofitting heat-exchanger networks Athier G, Floquet P, Pibouleau L, Domenech S
513 - 520	Quality criteria for process design in the design process - industrial case studies and an expert panel Herder PM, Weijnen MPC
521 - 528	Reliability and maintenance considerations in process design under uncertainty Vassiliadis CG, Pistikopoulos EN
531 - 536	Safety improvement by a multimedia operator education system Goh S, Chang B, Jeong I, Kwon HT, Moon I
537 - 544	Thermodynamic analysis and mathematical optimisation of power plants Manninen J, Zhu XX
545 - 552	Exergy analysis : An efficient tool for process optimization and understanding. Demonstrated on the vinyl-chloride plant of Akzo Nobel. Graveland AJGG, Gisolf E
555 - 562	Qualitative interpretation and compression of process data using clustering method Mo KJ, Eo S, Shin D, Yoon ES
563 - 570	Efficient modelling of partial resource equivalence in resource-task networks Dimitriadis AD, Shah N, Pantelides CC
571 - 578	The use of agents both to represent and to implement process engineering models Maguire PZ, Struthers A, Scott DM, Paterson WR
579 - 585	Sequencing of batch operations for a highly coupled production process : Genetic algorithms versus mathematical programming Lohl T, Schulz C, Engell S
587 - 593	Intelligent modelling in the chemical process industry with neural networks : a case study Meert K, Rijckaert M
595 - 600	Neural network based approach for optimisation applied to an industrial nylon-6,6 polymerisation process Nascimento CAO, Giudici R
601 - 608	iTOPS : An intelligent tool for operating procedures synthesis Viswanathan S, Mockus L, Venkatasubramanian V, Basu PK, Mack R, Cherukat P, Iskos V
611 - 614	Molecular dynamics calculations and Monte Carlo simulation of diffusivities in aqueous systems - Application to nitrate reduction on bimetal catalyst immobilized in poly(vinyl alcohol) hydrogel Fergg F, Keil FJ
615 - 618	Computer-aided molecular design with simulated annealing and molecular graphs Ourique JE, Telles AS
621 - 624	Optimal operation of dynamic processes under process-model mismatches : Application to batch distillation Mujtaba IM, Hussain MA
625 - 628	Control Vector Parametrisation versus Iterative Dynamic Programming in dynamic optimisation of a distillation column Fikar M, Latifi MA, Fournier F, Creff Y
629 - 632	Generalized Predictive Control to a packed distillation column for regulatory problems Karacan S, Hapoglu H, Alpbaz M
633 - 636	Optimal operation of rapid pressure swing adsorption with slop recycling Betlem BHL, Gotink RWM, Bosch H
637 - 640	Short-cut evaluation of pressure swing adsorption systems Chung Y, Na BK, Song HK
641 - 644	Gas-solid flow in cyclones : The Eulerian-Eulerian approach Meier HF, Mori M
645 - 648	Using rate-based approach under consideration of different contacting regimes for multicomponent batch distillation simulation Mehlhorn A, Nougues JM, Puigjaner L
649 - 652	Model identification of batch precipitations : application to salicylic acid Nallet V, Mangin D, Klein JP
653 - 656	Feasibility and sequencing studies for homoazeotropic distillation in a batch rectifier with continuous entrainer feeding Lelkes Z, Lang P, Otterbein M
659 - 662	New method for computer aided analysis of steady-state multiplicity of catalytic processes Kafarov VV, Pisarenko VN, Dallos CG, Keil F, Mayorga B, Nunez M
663 - 666	Computer aided method for construction of kinetic models of chemical reactions, based on application of Chebyshev-Hermite polynomials. Kafarov VV, Pisarenko VN, Dallos CG, Keil F, Duarte LA
667 - 670	Experimental studies and simulation of the dynamic behaviour of bubble column reactors Schulzke T, Schluter S, Weinspach PM
671 - 674	Synthesis of isothermal fluid-fluid two-phase CSTR networks Esparta ARJ, Obertopp T, Gilles ED
675 - 678	A dynamic kinetic model for methanol synthesis on deactivated catalyst Rahimpour MR, Bahri P, Kaljahi JF, Jahanmiri A, Romagnoli A
679 - 682	Three-phase reactor modeling with significant backmixing in the liquid phase using a modified cell model (MCM) Dassori CG
683 - 686	Simulation of silicon deposition from SiHCl3 in a CVD barrel reactor at atmospheric pressure De Paola E, Duverneuil P
687 - 690	Nonlinear estimation strategies for parameter estimation in chemical reactors Farza M, Hammouri H, Jallut C, Chouri V, Lieto J
691 - 694	Computer-aided optimisation of catalytic dehydrogenation in packed-bed membrane reactor Casanave D, Fiaty K, Dalmon JA
695 - 698	Improving safety of a pilot plant reactor using a model based fault detection and identification scheme Afonso PAFNA, Tavares JM, Castro JAAM
699 - 702	Modelling and sensitivity analysis of pyrolysis of biomass particles in a fluidised bed Semino D, Tognotti L
703 - 706	Effect of process design/operation on the open-loop operability of a polymerization reactor Flores-Tlacuahuac A, Silva-Beard A
707 - 710	Long term dynamic optimization of a catalytic reactor system Lovik I, Hillestad M, Hertzberg T
711 - 714	Computer aided design for large scale multitubular reactors Maciel R, McGreavy C
715 - 718	Dynamic simulation and control of an industrial surfactant reactor Khuu SM, Romagnoli JA, Bahri PA, Weiss G
719 - 722	Dynamic simulation of start-up procedures of reactive distillation columns Scenna NJ, Ruiz CA, Benz SJ
723 - 726	Modeling of real biological reactors for the treatment of complex substrates. Dynamic simulation Mussati M, Aguirre P, Scenna NJ
729 - 732	The integration of accident databases with computer tools in the chemical industry Chung PWH, Jefferson M
733 - 736	Design and optimisation of temperature cycled adsorptive reactors Yongsunthon I, Alpay E
737 - 740	Optimization of a secondary reflux and vaporization (SRV) distillation process using surface response analysis Batista E, Rodrigues MI, Meirelles AJ
741 - 744	Wastewater minimisation of industrial systems using an integrated approach Alva-Argaez A, Kokossis AC, Smith R
745 - 748	A new approach to integrated process systems engineering - the VIBE Agent environment Struthers A, Curwen R
751 - 754	Using CFD to understand the air circulation in a ventilated room Espi E, Berne P, Duverneuil P
755 - 758	Numerical simulation of chemical vapour deposition process in electric field Rudniak L
759 - 761	3D finite element simulation of fluid flow through a SMX static mixer Fradette L, Li HZ, Choplin L, Tanguy P
763 - 766	Fluid dynamic modelling and simulation of circulating fluidized bed reactors : analyses of particle phase stress models Alves JJN, Mori M
767 - 770	Using computational fluid dynamics to calculate transversal dispersion in a structured packed bed van Gulijk C
773 - 776	Optimization of isothermal-isobaric chemical vapor infiltration Sampath V, Palanki S
777 - 780	Design of multipurpose batch chemical plants using a genetic algorithm Bernal-Haro L, Azzaro-Pantel C, Domenech S, Pibouleau L
781 - 784	Concurrent engineering system for supporting STEP based activity model Hawtin JW, Chung PWH
785 - 788	Two-level model based design of solids processing systems Lakatos BG, Auer R
789 - 792	Design of multiproduct batch plants under demand uncertainty with staged capacity expansions Petkov SB, Maranas CD
793 - 796	A novel approach for retrofit and operations management of existing total sites Makwana Y, Smith R, Zhu XX
797 - 800	Intermediate storage in batch processing systems under stochastic equipment failures Mihalyko EO, Lakatos BG
801 - 804	Alternatives in the optimal allocation of intermediate storage tank in multiproduct batch plants Vecchietti AR, Montagna J
805 - 808	A hybrid strategy for dynamic process flowsheeting Riksheim HC, Hertzberg T
809 - 812	Retrofit by inspection using thermodynamic process visualisation Lakshmanan R, Banares-Alcantara R
813 - 816	A designer-controlled framework for the synthesis of heat exchanger networks involving non-isothermal mixers and multiple units over split streams Galli MR, Cerda J
817 - 820	Flexibility analysis and design of dynamic processes with stochastic parameters Bansal V, Perkins JD, Pistikopoulos EN
823 - 826	Strategies for modeling and control of nonlinear chemical processes using neural networks Wang H, Oh Y, Yoon ES
827 - 830	A B-spline based method for data compression, process monitoring and diagnosis Vedam H, Venkatasubramanian V, Bhalodia M
831 - 834	Multi-objective constraint control for FCC reactor-regenerator system Yang SH, Chung PWH, Wang XZ, McGreavy C
835 - 838	State Space Constrained Multivariable Predictive Control of a milk of lime blending tank Mata N, Alvarez T, de Prada C
839 - 842	Application of Nonlinear Generalised Minimum Variance control to a tubular flow reactor Alpbaz M, Hapoglu H, Guresinli C
843 - 846	Eliminating ambiguities in qualitative causal feedback Palmer C, Chung PWH
847 - 850	Combinatorial technique for short term scheduling of multipurpose batch plants based on schedule-graph representation Sanmarti E, Friedler F, Puigjaner L
851 - 854	Non-linear principal components analysis for process fault detection Jia F, Martin EB, Morris AJ
855 - 858	Modeling of Simulated Moving Bed chromatographic processes with regard to process control design Dunnebier G, Engell S, Klatt KU, Schmidt-Traub H, Strube J, Weirich I
859 - 862	An adaptive optimal control scheme based on hybrid neural modelling Costa AC, Alves TLM, Henriques AWS, Filho RM, Lima EL
863 - 866	Rigorous industrial dynamic simulation of a crude distillation unit considered valve tray rating parameters Chang B, Lee S, Kwon H, Moon I
867 - 870	Interactive supervision of batch distillation with advanced control capabilities Dechechi EC, Luz LFL, Assis AJ, Maciel MRW, Filho RM
871 - 874	Sensitivity analysis for project planning and scheduling under uncertain completions Samikoglu O, Honkomp SJ, Pekny JF, Reklaitis GV
875 - 878	Using model-checking for Timed Automata to parameterize logic control programs Kowalewski S, Engell S, Huuck R, Lakhnech Y, Lukoschus B, Urbina L
879 - 882	Feasible operating region of natural gas plants under feed perturbations Eliceche AM, Sanchez M, Fernandez L
883 - 886	Model predictive control of a nonlinear unstable process Ozkan L, Camurdan MC
887 - 890	Simulation support for recipe driven process operation Music G, Matko D
893 - 896	A hybrid neural network first principles approach to batch unit optimisation Martinez EC, Wilson JA
897 - 900	Simulation of a fixed bed system using a geometrically based adaptive grid method Fraga ES
901 - 904	Modelling and simulation of membrane fouling in batch ultrafiltration on pilot plant Rouvet F, Fiaty K, Laurent P, Liou JK
905 - 908	A two-zone model for liquid-to-wall mass transfer in a packed-bed reactor with single phase liquid flow Latifi MA, Lesage F, Midoux N
909 - 912	Simulation of an absorption column performance using feed-forward neural networks in nitric acid production Roj E, Wilk M
913 - 916	Digital simulation of an electrodeionization process Verbeek HM, Furst L, Neumeister H
917 - 920	Economic achievement of environmental regulation in chemical process industries Singh H, Smith R, Zhu XX
921 - 924	Simulation of velocity fields in a falling film with a free interface flowing over a wavy surface Negny S, Meyer M, Prevost M
925 - 928	Acoustics based on-line quality estimation Elsey J, Barton GW, Jungk S, Francis G, Sellahewa J, Chessari C
929 - 932	Numerical problems encountered in the simulation of reactive absorption : DAE index reduction and consistent initialisation Rascol E, Meyer M, Le Lann JM, Prevost M
933 - 936	diag - a structural diagnose tool for interconnection assignment in model building and re-use Soetjahjo J, Go YG, Bosgra OH
939 - 942	Optimal operation of a separation plant using Artificial Neural Networks Altissimi R, Brambilla A, Deidda A, Semino D
943 - 946	Process simulation using continuation method in complex domain Jalali F
947 - 950	Off-line scheduling a simple chemical batch process production plan using the ILOG scheduler Das BP, Shah N, Chung PWH
951 - 954	A parametric optimization approach for multiobjective engineering problems involving discrete decisions Dimkou TI, Papalexandri KP
955 - 958	An outer-approximation algorithm for the solution of multiparametric MINLP problems Dua V, Pistikopoulos EN
961 - 964	Multi-perspective models for process hazards analysis of large scale chemical processes Srinivasan R, Venkatasubramanian V
965 - 968	Identification of distributed parameter systems : A neural net based approach Gonzalez-Garcia R, Rico-Martinez R, Kevrekidis IG
969 - 972	Invariant inheritance in structured operating procedures described by Petri nets Kranicz B, Gerzson M, Hangos KM
973 - 976	On-line operational support system for faults diagnosis in process plants Chen BH, Wang XZ, McGreavy C
977 - 980	Waste analysis and minimization in batch and semibatch reactor operation through dynamic simulation and neural networks Calderon Z, Espuna A, Puigjaner L
981 - 984	Modeling and optimization of pulp and paper processes using neural networks Aguiar HCIL, Filho RM
985 - 988	Methods for evaluating uncertainties in dynamic simulation - A comparison of performance Torvi H, Hertzberg T
989 - 992	Adaptive hybrid neural models for process control Cubillos FA, Lima EL
993 - 996	Optimisation of process plant layout using genetic algorithms Castell CML, Lakshmanan R, Skilling JM, Banares-Alcantara R
997 - 1000	Hybrid, fuzzy and neural adaptation in case-based reasoning system for process equipment selection Koiranen T, Virkki-Hatakka T, Kraslawski A, Nystrom L
1001 - 1004	Neurofuzzy modeling of chemical process systems with ellipsoidal radial basis function neural networks and genetic algorithms Schmitz GPJ, Aldrich C
1005 - 1008	Rapid process modeling - model building methodology combining unsupervised fuzzy-clustering and supervised neural networks Ronen M, Shabtai Y, Guterman H
1009 - 1012	Synthesis of qualitative models by using intelligent feedback Hurme M, Dohnal M
1013 - 1016	Fuzzy modeling and flowsheeting of imprecise units Zhang PR, Qian Y
1019 - 1022	Enlarging the trim-loss problem to cover the raw paper mill Harjunkoski I, Westerlund T
1023 - 1025	On-line data reconciliation in chemical plants - Industrial application of known methods Dempf D, List T
1027 - 1030	Optimization of industrial scale scheduling problems in New Product Development Schmidt CW, Grossmann IE, Blau GE
1031 - 1034	Cost benefit analysis of refinery process data : Case study Alheritiere C, Thornhill NF, Fraser S, Knight MJ
1035 - 1038	Industrial application of data reconciliation Placido J, Loureiro LV
1039 - 1042	A planning model for refinery diesel production Moro LFL, Zanin AC, Pinto JM
1045 - 1060	First-principles-based molecular simulation of heterogeneous catalytic surface chemistry Neurock M, Hansen EW
1061 - 1069	Application of CAPE in industry - Status and outlook Mayer HH, Schoenmakers H
1071 - 1071	Process analysis, design, and control - a case study Perne R, Endesfelder A
1073 - 1084	SitEModelling (TM) : A powerful tool for total site energy optimization Wolff A, Groebel MJ, Janowsky R
1085 - 1088	Hardware and software perspectives in engineering computing Brochard L