Report for ANU Grants and Usage on the SGI PC From Jan 99 Through Dec 99


Project Project Title Number of SU CPU
Code Researchers Awarded Used
Allen (Chemistry, Faculty of Science)
w50 Molecular Dynamics Studies of Membrane Ion Channels 5 4000 5159
Baxter (Systems Engineering, RSISE)
v62 Automatic Feature Learning for OCR and Speech Recognition 2 50 0
Braun (Geodynamics, RSES)
m22 Three-dimensional Modelling of Crustal Deformation Coupled to Surface Processes 4 1625 561
Brent (CSL, RSISE)
k58 Applications of Integer Factorization 4 2000 15093
Chelvanayagam (Human Genetics, JCSMR)
x06 Mechanism of the GSTT2 Enzyme 3 1200 2094
x07 Flexibility of the GSTT2 Enzyme 3 1200 868
Chung (Chemistry, Faculty of Science)
w16 Analysis of Single Channel Currents Using Signal Processing Techniques Based on Hidden Markov Models 5 10300 12188
Collins (RSC)
s01 Molecular Potential Energy Surfaces by Interpolation 5 3160 3402
Cummins (Computational Molecular Biology, JCSMR)
u51 qm/MM Calculations on Solvated Molecules 3 6770 7125
Dewar (Theoretical Physics, RSPhysSE)
s55 Plasma Turbulence in 3-Dimensional Magnetically Confined Plasmas 9 125 0
Easteal (Human Genetics, JCSMR)
w02 Comparative Evolutionary Analysis of Mitochondrial Genomes Using Maximum Likelihood 3 3800 39
El-Khoury (Mathematics, Faculty of Science)
x23 Black Hole Soft X-Ray Transients 1 600 0
Ennis-King (Physical and Theoretical Chemistry, RSC)
x05 Electrokinetic Transport Properties of Ionic Systems 2 700 0
Evans (RSC)
r61 Strain Rate Dependence of Heat Transfer as Applied to Planar Poiseuille Flow 2 6000 2650
s02 Calculation of the Stability of Phase Space Trajectories using Molecular Dynamics Simulations 3 5200 1480
Fischer (Chemistry, Faculty of Science)
u01 Energies and Potential Surfaces of the Excited Electronic States of the Triazines 3 1300 7397
u54 Structures and Vibrational Frequencies of Pure Halocarbon Clusters, and Mixed Clusters with Water 3 1850 9216
Gibson (Membrane Biochemistry, JCSMR)
q11 A Combined Molecular Biological and Computer Graphics Study of Biologically Active Proteins 2 20 5
Gready (Computational Molecular Biology, JCSMR)
u53 Definition of the Chemical Mechanism of the Photosynthetic Enzyme Rubisco 6 5625 5563
v53 Hybrid Quantum Mechanical and Molecular Mechanical Studies of the Reaction Mechanism of Lactate and Malate Dehydrogenase 3 1200 1176
v54 Computation of Electron Densities of Proteins by a Classical Electrostatic Model 2 4700 4643
w05 Hybrid Quantum Mechanical and Molecular Mechanical Studies of the Reaction Mechanism of Dihydrofolate Reductase 4 5350 4979
x04 Simulation of the Structure of Sugar Chains of Glycoproteins 2 5150 5802
x11 Evaluation of the Potential of MOZYME for the Study of Enzyme Reaction Mechanisms 4 4500 4188
Gulacsi (Theoretical Physics, RSPhysSE)
x18 The Density Matrix Renormalization Group 3 2500 2314
Hall (Mathematics Research Section, SMS)
x21 Numerical implementation of locally parametric boundary estimation technique 2 600 318
Jakeman (CRES)
s31 Dynamic Separation of Catchment Water Balance 3 50 0
Kheifets (Electron Physics Unit, RSPhysSE)
x01 Non-perturbative Theory of Atomic Ionization with Two-electron Continuum 1 530 0
Knackstedt (Applied Mathematics, RSPhysSE)
w09 Large-scale Modeling of Multi-phase Flows in Heterogeneous Porous Media 6 6500 3061
Lilley (Seismology, RSES)
v63 Electrical Conductivity Structure of the Australian Continent 3 25 0
Lindesay (Geography, SREM)
s13 Modelling the Atmospheric Response to Mid-Latitude Forcing During Enso 2 100 0
Marrink (Applied Mathematics, RSPhysSE)
w10 Computation of Surface Forces 2 500 0
Martin (Laser Physics Centre, RSPhysSE)
w08 Strongly Driven 2,3,6 Level Quantum Systems 1 1000 546
McClelland (Physics and Theoretical Physics, Faculty of Science)
x19 Ligo Gravitational Wave Data Analysis 4 350 2
Ollis (Protein Structure, RSC)
s06 Protein Refinement and Engineering 8 550 145
Pace (Chemistry, Faculty of Science)
v64 ab initio Modelling of the Manganese Centre of Photosystem II 2 1350 2225
Petrie (Physical and Theoretical Chemistry, RSC)
w60 Ab Initio and Molecular Dynamical Studies on Systems of Chemical and Astrochemical Interest 3 300 154
Radom (Computational Quantum Chemistry, RSC)
k29 Gas-Phase Ion Chemistry 4 5040 4874
p03 Unusual Structural and Energetic Consequences of Ionization 7 3965 3701
q07 Chemistry of Free Radicals 4 1525 1130
q08 Theoretical Thermochemistry 2 2255 2001
r54 Planar Carbon 2 6820 6543
s08 Free Radical Polymerization Reactions 4 5620 5249
v01 Enzyme-Mediated Reactions 2 6085 5512
v55 Ion-Neutral Complexes 6 2745 1861
v56 Small Ring Phosphorus Chemistry 5 2335 4529
Ramsden (Aust Centre Arts and Technology, Canberra Institute of the Arts)
x17 Rendering Computer Animated Representations of Scale 1 2000 0
x22 Rendering of Nanotechnology Computer Animation Sequences 1 1200 0
Sambridge (Seismology, RSES)
r58 Applications of Computational Geometry to Large Scale Geophysical Inverse Problems 1 100 0
Savage (Physics and Theoretical Physics, Faculty of Science)
u57 Quantum Trajectories in Atom Optics 3 300 2
w17 Relativistic Optics 3 200 0
Schranz (ANUSF, ITS)
s10 Efficient Calculation of Statistical and Dynamical Reaction Rates for Large Dimensional Molecular Systems 2 95 386
Stranger (Chemistry, Faculty of Science)
x24 Magnetic Interactions in Transition Metals 2 1000 382
Taylor (CRES)
m33 A 3-D Tropospheric Transport and Chemistry Model 6 50 0
Torda (Inorganic Chemistry, RSC)
v04 Development and Application of Protein Fold Recognition Force Fields 4 1800 395
w51 Blending Protein Secondary Structure Information and Knowledge-Based Force Fields 4 2000 1217
x08 NMR Spectral Assignment Using Structural Information 2 800 0
Welberry (RSC)
p05 Computation of X-ray Diffraction Patterns for 3D Model Systems 4 610 13
Wickramasinghe (Mathematics, Faculty of Science)
w56 Accretion Disks Around Black Holes in Compact Binaries 4 1200 24
Worrall (Aust Centre Arts and Technology, Canberra Institute of the Arts)
v57 Batch Rendering of Computer Animated Sequences 2 6073 2625
Totals* 144598 142837


* Totals include projects not listed here which made little or no use of the grant