## Computational Science - ICCS 2003. Part 4.: International Conference Melbourne, Australia and St. Petersburg, Russia, June 2-4, 2003, Proceedings,The four-volume set LNCS 2657, LNCS 2658, LNCS 2659, and LNCS 2660 constitutes the refereed proceedings of the Third International Conference on Computational Science, ICCS 2003, held concurrently in Melbourne, Australia and in St. Petersburg, Russia in June 2003. The four volumes present more than 460 reviewed contributed and invited papers and span the whole range of computational science, from foundational issues in computer science and algorithmic mathematics to advanced applications in virtually all application fields making use of computational techniques. These proceedings give a unique account of recent results in the field. |

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### Contents

A Model for Predicting the Optimum Checkpoint Interval for Restart Dumps | 3 |

Terascale IO Solutions | 13 |

A Performance Analysis Case Study | 23 |

RealTime Terascale Implementation of Teleimmersion | 33 |

Performance Analysis of PHASTA on NCSA Intel IA64 Linux Cluster | 43 |

Performance Instrumentation and Measurement for Terascale Systems | 53 |

Logging Kernel Events on Clusters | 63 |

Recent Advances in QM and QMMM Methods | 75 |

Mobile Animation Algorithm for Cyber Museum | 586 |

Certificate Management Client System for Etransactions on Internet | 596 |

Threat Description for the PP by Using the Concept of the Assets Protected by TOE | 605 |

RealTime Data Management for Network Information System | 614 |

Efficient Migration Algorithm for Mobile Agents in WiredWireless Internets | 626 |

Anecdotes from Practice | 637 |

Investigating Memory Placement on the SCI Origin 3000 | 648 |

Myth or Reality? | 657 |

UTChem A Program for ab initio Quantum Chemistry | 84 |

Local Correlation Models | 96 |

Multiresolution Quantum Chemistry in Multiwavelet Bases | 103 |

Management of Web and Associated Grid Technologies for Quantum Chemistry Computation | 111 |

A Problem Solving Environment for High Performance Theoretical Chemistry | 122 |

Computational Quantum Chemistry Experiments via the Web | 132 |

A Fortran Based ObjectOriented System for Quantum Chemistry and Crystallography | 142 |

Explicitly Correlated Second Order Perturbation Theory with Frozen GaussianType Geminals | 152 |

Molecular Potential Energy Surfaces by Interpolation | 159 |

New Functionality | 168 |

Interfacing Computer Aided Parallelization and Performance Analysis | 178 |

Dynamic Performance Tuning of Distributed Programming Libraries | 191 |

Parallel Program Debugging with MAD A Practical Approach | 201 |

Enhancing Prediction Accuracy in PCMBased File Prefetch by Constrained Pattern Replacement Algorithm | 211 |

Parallel IO Scheduling in Multiprogrammed Cluster Computing Systems | 223 |

Design and Evaluation of Distributed Smart Disk Architecture for IOIntensive Workloads | 230 |

An Adaptive Load Balancing Algorithm for Large Data Parallel Processing with Communication Delay | 242 |

A Flexible Multiagent Parallel File System for Clusters | 248 |

TradingOff IO Throughput and QoS Guarantee | 257 |

Computational Aspects of Chemical Data Assimilation into Atmospheric Models | 267 |

Virtual Telemetry for Dynamic DataDriven Application Simulations | 279 |

Tornado Detection with Support Vector Machines | 289 |

Computational Science Simulations Based on Web Services | 299 |

A Data Driven Environment for Multiphysics Applications | 309 |

Discrete Event Solution of Gas Dynamics within the DEVS Framework | 319 |

A Dynamic Data Driven Application System | 329 |

Derivation of Natural Stimulus Feature Set Using a DataDriven Model | 337 |

Performance Evaluation of Generalized Polynomial Chaos | 346 |

Driving Scientific Applications by Data in Distributed Environments | 355 |

Simulating Sellers Behavior in a Reverse Auction B2B Exchange | 365 |

Component Encapsulation Using XML | 375 |

A Computational Infrastructure for Reliable Computer Simulations | 385 |

Automating Metadata Web Service Deployment for Problem Solving Environments | 391 |

Building Problem Solving Environments with Application Web Service Toolkits | 403 |

A Problems Solving Environment Supporting Multimodels Parallel Grid Programming | 413 |

Implementation of a GridEnabled Problem Solving Environment in Matlab | 420 |

PSE Infrastructure for Dynamic ServiceOriented Grid Applications | 430 |

Partial Dual Unicasting Based Handoff for RealTime Traffic in MIPv6 Networks | 443 |

Simulations on Batching in VideoonDemand Transmissions | 453 |

The Design of XMLBased Internet Security Integrated System Architecture | 463 |

Performance Analysis of a Mobility Support Scheme between Subnetworks in Differentiated Services | 473 |

Performance Analysis for RealTime Grid Systems on COTS Operating Systems | 482 |

Scalable Keyframe Extraction Using OneClass Support Vector Machine | 491 |

A Design and Performance Evaluation of 2Level Call Admission Control Scheme in Mobile Multimedia Networks | 500 |

Performance Evaluation of a Relocation Method for Mobile Computing Maintaining Data Consistency | 510 |

Reliability Problem on All Pairs Quickest Paths | 518 |

A Concurrency Control Algorithm for Firm RealTime Database Systems | 524 |

Secure Firewall Traversal in Mobile IP Network | 535 |

Buffering Management Scheme for Multimedia Synchronization in Mobile Information System | 545 |

Resource Reservation and Allocation Based on Direction Prediction for Handoff in Mobile Multimedia Networks | 555 |

PetriNet Model of Multimedia Synchronization in Mobile Environment | 566 |

New Mobility Scheme for Reducing Location Traffic in Mobile Networks | 576 |

Asynchronous Execution of OpenMP Code | 667 |

A Visualisation Framework for Marine Simulation Models | 679 |

Modelling Developmental Regulatory Networks | 688 |

A Biomechanical Imitative Model for Pulsatile Morphogenesis | 698 |

Using Computational Plant Science Tools to Investigate Morphological Aspects of Compensatory Growth | 708 |

3D Visualization of Complex Surfaces Using Dynamic Delaunay Tessellation | 718 |

A Developers Tool for Efficient Code Generation and Optimization | 729 |

A Knowledge Discovery Methodology for Behavior Analysis of Largescale Applications on Parallel Architectures | 739 |

Performance Modeling for Dynamic Algorithm Selection | 749 |

SelfAdapting Numerical Software and Automatic Tuning of Heuristics | 759 |

Computer Simulation of Multidimensional Bone Deformity Correction and Lengthening by Unilateral External Fixator | 768 |

Problems and Prospects for Quantum Computational Speedup | 779 |

A Configuration Algorithm for Provisioning of CellBased MPLS Network | 789 |

Exact and Approximate Algorithms for Topological Design of Wide Area Networks with Nonsimultaneous Single Commodity Flows | 799 |

Modeling and Simulation of Distributed Security Models | 809 |

An Efficient Collective Communication Method for Grid Scale Networks | 819 |

Reliability Theory Model and Expected Life Shortest Path in Stochastic and TimeDependent Networks | 829 |

Using a GA Adaptor in Multiapplications | 839 |

Automated Debugging in Java Programs Using HDM | 849 |

A Newsfeed Example | 859 |

Evolutionary Rule Generation Classification and Its Application to Multiclass Data | 868 |

SelfOrganizing Hybrid Neurofuzzy Networks | 877 |

A Framework for Metaheuristic Optimization | 886 |

Easy MPI Programming in C++ | 896 |

A Novel Evolutionary Approach to Linear TimeSeries Forecasting Model | 903 |

Design and Implementation of XML DBMS Based on Generic Data Model | 911 |

Developing a Unified Design Methodology Based on Extended EntityRelationship Model for XML | 920 |

Investigating Neural Network Modeling Decisions for the Australian AllOrdinaries Index | 930 |

Rapid Prototyping Methodology and Environments for Fuzzy Applications | 940 |

Multiple Correlation Analysis of Fuzzy Sets | 950 |

An Efficient Dispersal and Encryption Scheme for Secure Distributed Information Storage | 958 |

A DTD for an XMLBased Mathematical Modeling Language | 968 |

A CompressBased Association Mining Algorithm for Large Dataset | 978 |

Engineering Persistent Queue System for a Unified Stock Transaction Platform | 988 |

An Efficient Algorithm for Computing Inverses in GF2m Using Dual Bases | 994 |

Object Oriented Parallel Programming Model on a Network of Workstations | 1000 |

Paroxysmal Atrial Fibrillation Prediction Application Using Genetic Algorithms | 1011 |

A Metadata Tool for Retrieval from Heterogeneous Distributed XML Documents | 1020 |

Effective Similarity Search Methods for Large Video Data Streams | 1030 |

Application of the Cutting Angle Method to Molecular Structure Prediction | 1040 |

Performance Characteristics of a CostEffective MediumSized Beowulf Cluster Supercomputer | 1050 |

A Novel Approach to RoleBased Access Control | 1060 |

Designated Verification of Digital Watermark for Network Based Image Distribution | 1069 |

A Parallel Loop SelfScheduling on Extremely Heterogeneous PC Clusters | 1079 |

Robust Reference Point Detection Using Gradient of Fingerprint Direction and Feature Extraction Method | 1089 |

GPDBased State Modification by Weighted Linear Loss Function | 1100 |

Spectral Subtraction Using Spectral Harmonics for Robust Speech Recognition in Car Environments | 1109 |

A Workflow Management and Grid Computing Approach to Molecular SimulationBased BioNano Experiments | 1117 |

Simulation Infrastructure for Modeling Large Scale Neural Systems | 1127 |

Monotone Iterative Methods and Schwarz Methods for Nonlinear Parabolic PDE with Time Delay | 1137 |

Author Index | 1149 |

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### Common terms and phrases

agent algorithm analysis application approach architecture bandwidth Berlin Heidelberg 2003 buffer calculations called cell Charm++ client cluster components computational chemistry Computer Science correlation database dataset debugging defined developed disk distributed dynamic elements environment equation error evaluation execution function fuzzy attribute GAMESS Genetic Algorithms Grid handoff I/O scheduling ICCS IEEE implementation input integrated interface Internet IPSec iterations Java LNCS mailbomb memory method mobile Mobile IP module Mqos multimedia multiple node NWChem object OpenMP operations optimal output P.M.A. Sloot parallel Parallel Computing parameters path pattern performance polynomial chaos prediction problem processors proposed quantum quantum chemistry query queue real-time request scalability scheme server simulation solution Springer-Verlag Berlin Heidelberg structure techniques tool transaction variables vector visualization Web services WSDL XML schema