article
, "A Unique Approach to Metal-Induced Bergman Cyclization: Long Range Enediyne Activation by Ligand-to-Metal Charge Transfer", Chemie International Edition, vol. 44, pp. 592-595, . 2005.
, "Ligand-assisted Spin Delocalization in Dicopper(I,II) Cores: Use of Bulky Amidnate Ligands to Access Novel Tetra- and Dicopper Clusters", Chemical Communications, . 2005.
, "Diasteroselective Intermolecular Rhodium-Catalyzed [4+2+2] Carbocyclization Reactions: Computational and Experimental Evidence for the Intermediacy of a New Metallocycle Intermediate", Evans Journal of the American Chemical Society, . 2005.
, "Mesoscopic theory of multi-phase structures and macromolecule-fluid interactions", Journal of Computational Chemistry, . 2005.
, "Inter-annual variability of wind indices over Europe.", Wind Energy, . 2005.
, "Homogeneous Agent-Based Distributed Information Filtering.", Cluster Computing, . 2005.
, "An Intelligent Biological Information Management System", Bioinformatics, . 2005.
, "Mapping the Proteome of Drosophila melanogaster: Analysis of Embryos and Adult Heads by LC-IMS-MS Methods", Analytical Chemistry, . 2005.
, "Proteome Profiling for Assessing Diversity: Analysis of Individual Heads of Drosophila melanogaster using LC-Ion Mobility-MS", Analytical Chemistry, . 2005.
, "Generic Programming and High-Performance Libraries.", International Journal of Parallel Programming, . 2005.
, "Semileptonic decays of $D$ mesons in three-flavor lattice QCD.", Phys. Rev. Lett., vol. 94, no. 011601, . 2005.
, "Terminal and Four-Coordinate Vanadium(IV) Phosphinidene Complexes. A Pseudo Jahn-Teller Effect of Second Order Stabilizing the V-P Multiple Bond", Journal of the American Chemical Society, vol. 126, pp. 1924-1925, . 2004.
, "Terminal Vanadium-Neopentylidyne Complexes and Intramolecular Wittig Reactions to Generate Azametalacyclohexatrienes", Journal of the American Chemical Society, vol. 126, pp. 10506-10507, . 2004.
, "Proton as the Simplest of All Catalysts for [2+2] Cycloadditions: DFT Study of Acid-Catalyzed Imine Metathesis", Journal of Organic Chemistry, vol. 69, pp. 6173-6184, . 2004.
, "Terminal Acetylenes React to Increase Unsaturation in [(tBu2PCH2SiMe2)2N]Re(H)4", Organometallics, vol. 23, pp. 4934-4943, . 2004.
, "Peptidoglycan recognition proteins (PGRPs).", Molecular Immunology, vol. 40, pp. 877-886, . 2004.
, "Electronic Structure of the Water-Oxidation Catalyst [(bpy)2(OHx)RuORu(OHy)(bpy)2]z+: Weak Coupling between the Metal Centers Is Preferred over Strong Coupling", Journal of the American Chemical Society, vol. 126, pp. 13222-13223, . 2004.
, "The generalized earthquake location (GENLOC) package: A modern earthquake location library", Computers in Geosciences, vol. 20, pp. 1079-1091, . 2004.
, "Simulating multi-scale cellular reaction-transport processes", Physical Review E, . 2004.
, "Simulated nonlinear dynamics of glycolysis in the protozoan parasite Trypanosoma brucei", Journal of Theoretical Biology, . 2004.
, "An evaluation of two GCMs: Simulation of North American teleconnection indices and synoptic phenomena", International Journal of Climatology., . 2004.
, "The impact of non-stationarities in the climate system on the definition of a normal wind year: A case study from the Baltic.", International Journal of Climatology., . 2004.
, "Development of High-Throughput Dispersive LC-Ion Mobility-TOFMS Techniques for Analyzing the Human Plasma Proteome", Briefings of Funct. Genomics & Proteomics, vol. 3, pp. 177-186, . 2004.
, "Pion and kaon physics with improved staggered quarks.", Nucl. Phys., vol. B129-130, pp. 227, . 2004.
, "Results on improved KS dynamical configurations: spectrum, decay constants, etc.", Nucl. Phys., vol. B 129-130, pp. 17, . 2004.
, "Results on improved KS dynamical configurations: spectrum, decay constants, etc.", Nucl. Phys., vol. B 128, pp. 72, . 2004.
, "Light hadrons with improved staggered quarks: approaching the continuum limit.", Phys. Rev., vol. D 70, no. 9, . 2004.
, "First determination of the strange and light quark masses from full lattice QCD", Phys. Rev., vol. D 70, . 2004.
, "Light pseudoscalar decay constants, quark masses, and low energy constants from three-flavor lattice QCD.", Phys. Rev., vol. D 70, no. 114501, . 2004.
, "A Parallelized 3D Unstructured Euler Solver For Unsteady Aerodynamics.", AIAA Journal of Aircraft, vol. 40, no. 2, pp. 348-354, . 2003.
, "Defect in neutrophil killing and increased susceptibility to infection with non-pathogenic Gram-positive bacteria in peptidoglycan recognition protein-S (PGRP-S)-deficient mice.", Blood, vol. 102, pp. 689-697, . 2003.
, "Human peptidoglycan recognition protein-L is an N-acetylmuramoyl-L-alanine amidase.", Journal of Biological Chemistry, vol. 278, pp. 49044-49052, . 2003.
, "Karyote: physico-chemical genome, proteome, metabolome cell modeling system", OMICS: A Journal of Integrative Biology, vol. 7, pp. 169-183., . 2003.
, "Simulating cellular dynamics through a coupled transcription, translation, metabolic model", Computational Biology and Chemistry, vol. 27, no. 4-5, pp. 469-481, . 2003.
, "Density functional theory of orientational order at inferfaces: application to water", Journal of Chemical Physics, . 2003.
, "Toward Automated Cell Model Development through Information Theory", Journal of Physical Chemistry, vol. A 107, pp. 10554-10565., . 2003.
, "Efficient solution Technique for Solving the Poisson-Boltzmann Equation", Journal of Computational Chemistry, vol. 25, pp. 1068-1074, . 2003.
, "Evaluation of the NCEP/NCAR reanalysis in terms of synoptic scale phenomena: A case study from the Midwestern USA.", International Journal of Climatology, vol. 23, pp. 1725-1741, . 2003.
, "A Comparative Study of Genetic Sequence Classification Algorithms", Journal of VLSI Signal Processing-Systems for Signal, Image, and Video Technology, . 2003.
, "New space warping method for the simulation of large-scale macromolecular conformational changes", Journal of Computational Chemistry, vol. 23, no. 1, pp. 484-491, . 2002.
, "The XCAT Science Portal.", Journal of Scientific Programming, vol. 10, no. 4, pp. 303--317, . 2002.
, "Fusion Simulation Project: Integrated Simulation and Optimization of Magnetic Fusion Systems.", Journal of Fusion Energy, vol. 20, no. 4, pp. 135--196, December. 2002.
, "Programming the Grid: Distributed Software Components, P2P and Grid Web Services for Scientific Applications.", Cluster Computing, vol. 5, no. 3, pp. 325--336, July. 2002.
conference
, "A combinatorial DFT study of how cisplatin binds to purine bases.", . 2005.
, "Algorithmic Detection of Semantic Similarity.", . 2005.
, "Lifting Sequential Graph Algorithms for Distributed-Memory Parallel Computation.", . 2005.
, "Data Redistribution and Remote Method Invocation in Parallel Component Architectures.", , 4-8 April. 2005.
, "The AVIDD Linux Clusters", , March. 2004.
, "Advances in Parallel Metacomputing of Solid-Fluid Interaction Problems", , March. 2004.
, "Four-coordinate alkylidene, alkylidyne and phosphinidene complexes of vanadium: One and two-electron oxidatively-induced a-hydrogen abstraction reactions.", . 2004.
, "Probing the terminal alkylidene, imide, and phosphinidene functionalities of four-coordinate Ti(IV) and V(IV) complexes.", . 2004.
, "A Combinatorial DFT Study of How Cisplatin Binds to Purine Bases", . 2004.
, "DCA: A Distributed CCA Framework Based on MPI.", , 26--30 April. 2004.
, "1 TeraFLOPS achieved with distributed Linux cluster", , November. 2003.
, "Global analysis of arthropod evolution", , November. 2003.
, "Computational Biology", , November. 2003.
, "Linux in High Performance Computing at IU", , April. 2003.
, "Handling the Data Deluge at Indiana University", , October. 2003.
, "The Centralized Life Sciences Data (CLSD) Service", , October. 2003.
, "The Centralized Life Sciences Data (CLSD) Service", , October. 2003.
, "High Performance Storage at Indiana University", , September. 2003.
, "High Performance Storage at Indiana University", , October. 2003.
, "The Centralized Life Sciences Data Service (CLSD) and supported applications at Indiana University", , September. 2003.
, "High Performance Computing Resources at IU", , July. 2003.
, "High Performance Computing Resources at IU", , July. 2003.
, "HPSS at Indiana University: A Site Report", , June. 2003.
, "The Centralized Life Sciences Data (CLSD) Service", , June. 2003.
, "Negotiating Virtual and Physical Museum Space", , Oct. 2003.
, "Parallel Computing for Aeroelasticity Problems", , June 22-25. 2003.
, "Video Scene Analysis Using Best Basis Wavelets and Learning Strategies", . 2002.
, "Video Indexing and Retrieval for Archeological Digital Library", , July. 2002.
, "A Comparative Study of Genetic Sequence Classification Algorithms", . 2002.
, "An Authorization Framework for a Grid Based Component Architecture.", , November. 2002.
inbook
. 2004. "Parallel computing: software technology, algorithms, architectures & applications." volume 13. series Advances in Parallel Computing. Parallel computing in biomedical research and the search for peta-scale biomedical applications.:719-716. Elsevier. Oxford.
. 2002. "Resource Recovery, Confinement, and Remediation of Environmental Hazards, Institute of Mathematics and its Applications" volume 131. Probability functionals, homogenization and comprehensive reservoir simulators.:161-178. Springer-Verlag. New York.
incollection
. 2005. Part 4, Cluster and Grid Computing, High Performance Computing, Paradigm and Infrastructure John Wiley & Sons.
. 2005. Parallel CFD 2004 Elsevier Science.
. 2005. Parallel CFD 2004 Elsevier Science.
. 2004. Parallel CFD 2003 Elsevier Science.
. 2004. Parallel CFD 2003
. 2003. Parallel CFD 2003 Elsevier Science.
. 2003. Parallel CFD 2002 Elsevier Science.
. 2003. Parallel CFD 2002 Elsevier Science.
. 2003. Parallel CFD 2002 Elsevier Science.
inproceedings
, "A global grid for analysis of arthropod evolution.", , pp. 328-337., November. 2004.
, "Open MPI: Goals, Concept, and Design of a Next Generation MPI Implementation.", , September. 2004.
, "The Component Architecture of Open MPI: Enabling Third-Party Collective Algorithms.", , July. 2004.
, "TEG: A High-Performance, Scalable, Multi-Network Point-to-Point Communications Methodology.", , September. 2004.
, "Open MPI's TEG Point-to-Point Communications Methodology: Comparison to Existing Implementations.", , September. 2004.
, "Semileptonic $D ightarrow pi/K$ and $B ightarrow pi/D$ decays in 2+1 flavor lattice QCD.", . 2004.
, "OSCAR Clusters.", , July. 2003.
, "A Component Architecture for LAM/MPI.", , October. 2003.
, "A Component Architecture for LAM/MPI.", , June. 2003.
, "An Approach to Parallel MxN Communication.", , October. 2003.
, "Merging the CCA Component Model with the OGSI Framework.", , March. 2003.
, "A Multi-level Text Mining Method to Extract Biological Relationships,", , pp. 97--108., August. 2002.
, "Investigating the Limits of SOAP Performance for Scientific Computing.", , July. 2002.
phdthesis
, "A Component Architecture for the Message Passing Interface (MPI): The Systems Service Interface (SSI)", PhD Thesis, University of Notre Dame, Notre Dame, IN, 2004.
Seminar/Talk
. 2003. "Resources for Bioinformatics at Indiana University" Presented to School of Informatics class, IUPUI. Seminar/Talk.
techreport
. 2005. "A Data Management Architecture for Computational Biology."Num. TRxxx,. Department of Computer Science, Indiana University.
. 2005. "Data Redistribution and Remote Method Invocation in Parallel Component Architectures"Num. TR604. Department of Computer Science, Indiana University..
. 2004. "Report of the Fusion Simulation Project Steering Committee"Num. LA-UR-04-5930.. Los Alamos Nation Laboratory.
. 2004. "An Instrument/Sensor Analysis of the MMSF Automated Photometric Telescope."Num. 597. Computer Science Department Indiana University.
. 2003. "Retaining Path-Sensitive Relations across Control-Flow Merges."Num. 03-15. Rensselaer Polytechnic Institute.
. 2003. "McMullen Instruments and Sensors as Network Services: Making Instruments First Class Members of the Grid."Num. 588. Computer Science Department, Indiana University..


