10 Minutes Q&A (in session "DIRISA")
10 Minutes Q&A (in session "DIRISA")
2017 HPC Landscape and Technology Trends (in session "Plenary")
A DFT study of the ODH of n-hexane over isolated H3VO4 and H4V2O7 (in session "Chemistry")
A DFT study of the ring opening mechanism of tetraethyl-2-aryl-1,2-epoxygembisphosphonates (in session "Chemistry")
A high performance computing approach to cosmic-ray modulation. (in session "Earth Science")
A next generation institutional repository for ALL South African research (in session "DIRISA")
Accelerating Big Data Processing and Associated Deep Learning on Modern HPC Clusters and Clouds (in session "Cognitive Computing and Machine Learning")
Accelerating the 3-D FFT using a heterogeneous FPGA architecture (in session "HPC")
Adjusting empirical relationships in a turbulence model (in session "Computational Mechanics")
An Assessment of the Maturity of the SA NREN (in session "SA NREN")
An Integrative Approach to Generating a Reference Transcriptome for Sugarcane (in session "BioInformatics")
Applications of machine learning: Developing natural language processing technology for South Africa's official languages (in session "Cognitive Computing and Machine Learning")
Best Practices… No, Good Enough Practices, for Building an eResearch enabled Institution - The NWU eResearch Story (in session "DIRISA")
Beyond Li-ion: Computational Modelling Studies on Stability of Li-S-Se System (in session "Material Science")
Big Data Meets HPC: Exploiting HPC Technologies for Accelerating Big Data Processing and Management (in session "Sunday Workshop: Big Data Meets HPC")
Bioinformatics gone Wild! (in session "BioInformatics")
Can we reach the heaven of chemical accuracy by climbing Jacob’s Ladder? A DFT validation study for Non-heme Iron complexes (in session "Chemistry")
Charge transport, interfacial interactions and synergistic mechanism in BiNbO4/MWO4 (M = Zn and Cd) heterostructures for hydrogen production: insights from a DFT+U study (in session "Material Science")
CHPC Induction Mini-course (in session "Thursday Workshop: CHPC Induction Course")
CHPC Industry Engagement Meeting (in session "CHPC Industry Engagement Meeting")
CODE-RADE offloading software building from sites. (in session "HPC")
Computation and the future of biological research (in session "BioInformatics")
Computational Aeroacoustic Modelling Using Hybrid RANS/LES Methods With Modified Acoustic Analogies (in session "Computational Mechanics")
Computational and experimental study on heats of adsorption of MBT, MBO and MBI onto pyrite mineral surfaces (in session "Material Science")
Computational chemistry methods in understanding the properties of porous material (in session "Chemistry")
Computational Fluid Dynamics in Renewable Energy and High-Speed Transport (in session "Computational Mechanics")
Computational Intelligence and Algorithmic Mechanism Design: an Application in Revenue Optimisation (in session "Cognitive Computing and Machine Learning")
Computational modeling as a complementary and predictive tool in materials science research (in session "Material Science")
Computational Modeling to support the development of biosensing devices (in session "Chemistry")
Computational modelling of furnace tapholes – a case study in life at the interface between academic and industrial research (in session "Computational Mechanics")
Computational study of anatase TiO2 as an anode material energy storage devices (in session "Material Science")
Computations on the CHPC: Evaluation of the COSMO model (in session "Earth Science")
Deep Learning: Research Directions and Upcoming Challenges (in session "Cognitive Computing and Machine Learning")
DENSITY FUNCTIONAL STUDY OF ELECTRONIC, OPTICAL AND ADSORPTION PROPERTIES DYE ON ANATASE AND BROOKITE TIO2 SURFACES FOR APPLICATION IN DYE SENSITIZED SOLAR CELLS (in session "Material Science")
Detailed projections of future climate change over Africa: the Variable Resolution Earth System Model and supercomputing on the CHPC Lengau cluster (in session "Earth Science")
DFT for isomers in solution, redox potentials, transition states and favored reaction products (in session "Chemistry")
DMol3/COSMO-RS Prediction of Aqueous Solubility and Reactivity of Selected Azo Dyes: Effect of Global Orbital Cut-off and COSMO Segment Variation (in session "Material Science")
Dramatic Changes for HPC Storage and IO (in session "Plenary")
Effect of pressure on structural, mechanical, dynamical and electronic properties of ReSe2 :A theoretical investigation (in session "Material Science")
ELSI: A unified software interface for Kohn-Sham electronic structure solvers (in session "Material Science")
EMPRESS--Extensible Metadata PRovider for Extreme-scale Scientific Simulations (in session "Storage and I/O")
Enabling The Era of Data-Centric HPC (in session "HPC")
Evaluation of Soil Moisture in the Coupled CCAM-CABLE Model over South Africa Using In-Situ and ESA CCI Satellite Observations (in session "Earth Science")
Expanding the borders of Nelson Mandela University – Strategic partnerships to enable high speed university connectivity in Nelson Mandela Bay (in session "SA NREN")
Exploring chemical space using in silico studies to identify novel inhibitors of Acetylcholinesterase, a target for Alzheimer’s disease (in session "Chemistry")
FAMSEC-based insight on the chemical nature of the XH...HY (X,Y = C,N) intramolecular interactions (in session "Chemistry")
H3ABioNet –enabling bioinformatics and big data research in Africa (in session "BioInformatics")
Heatwaves in the future warmer climate of South Africa (in session "Earth Science")
High Performance Computing at the South African Weather Service (in session "Earth Science")
HPC configuration management using Puppet 5 (in session "Thursday Workshop: HPC configuration management using Puppet 5")
HPC Storage – the two distinct challenges (in session "Storage and I/O")
HPC Topics in African University Courses (in session "HPC Education BoF")
In silico identification and structural bioinformatics of druggable protein targets in Schistosoma Species (in session "BioInformatics")
Incentives driving data sharing: an African perspective (in session "DIRISA")
Innovation in the Network and Security Space (in session "SA NREN")
Intel AI Workshop (in session "Sunday Workshop: Intel AI/Deep Learning")
Intel HPC and AI Technologies (in session "Cognitive Computing and Machine Learning")
Intel Plenary TBA (in session "Plenary")
Introduction to HPC (in session "Sunday Workshop: Introduction to HPC")
Introduction to Parallel Computing with OpenMP (in session "Thursday Workshop: Introduction to Parallel Computing with OpenMP")
Introduction to Schrödinger’s drug discovery tools (in session "Sunday Workshop: Introduction to Schrödinger’s drug discovery tools")
Investigation of the interaction between selected divalent cations and the novel Schistosoma mansoni Universal stress protein G4LZI3. (in session "BioInformatics")
Lead optimization: calculating relative binding free energies with FEP+ (in session "Chemistry")
Learning image interest and saliency from pairwise image comparisons (in session "Cognitive Computing and Machine Learning")
Libraries enabling Open Data: UCTs new Institutional Data Repository (in session "DIRISA")
Limits of Langmuir (in session "Material Science")
Machine Learning Based Bitcoin Price Prediction (in session "Cognitive Computing and Machine Learning")
Machine Learning in the Era of Data Intensive Astronomy (in session "Cognitive Computing and Machine Learning")
Machine learning tools for visualising big data. (in session "Cognitive Computing and Machine Learning")
Mechanisms of the Sea-Air CO2 Flux Seasonal Cycle biases in CMIP5 Earth Systems Models in the Southern Ocean (in session "Earth Science")
MODELLING ADVANCED MATERIALS WITH HIGH PERFORMANCE COMPUTING (in session "Material Science")
Modelling of Multiphase Flow in Process Equipment: The Trade-off between Accuracy and Computational Efficiency (in session "Computational Mechanics")
Modelling the low frequency variability of the Indian Ocean. (in session "Earth Science")
Modelling the variability of convection over East Rand South Africa (in session "Earth Science")
Molecular modelling of lanthanide(III) chloride complexes with the nitrogen ligand DPA: AIM/NCI analysis and ligand conformational search (in session "Chemistry")
Molecular modelling of ligands, receptors and enzymes for in silico drug discovery (in session "Chemistry")
Numerical modeling of transients in the solar modulation of astroparticles (in session "Earth Science")
Ocean-biogeochemical model sensitivity in the Southern Ocean towards the development of the earth system model, CSIR-VR-ESM (in session "Earth Science")
Opening of the 11th CHPC Conference (in session "Plenary")
OpenPOWER Workshop (in session "Thursday Workshop: Deep Learning training course: OpenPOWER and AI")
Overview of HPC course and textbook (in session "HPC Education BoF")
Panel Discussion: Making Data Sharing Work (in session "DIRISA")
Parallel visualization on Lengau with Paraview and VisIt (in session "Sunday Workshop: Parallel visualization on Lengau with Paraview and VisIt")
Performance Analysis of an HPC Implementation for Large-Scale Propagation Prediction (in session "Computational Mechanics")
Phase diagram for the adsorption of oxygen and water on Pt(100) and Pt(111) (in session "Material Science")
Poster Awards (in session "Plenary")
Probing the catalytic mechanism of an antifibrotic copper metallodrug (in session "Chemistry")
Programmable Storage Systems (in session "Storage and I/O")
Progress on The SADC Cyberinfrastructure Framework: Supporting Open Data and Open Science in the region (in session "Plenary")
Prospects for improving coastal modelling in the Benguela region (in session "Earth Science")
Representative of the Mayor's office (in session "Plenary")
Scientific Modeling of Storage System Reliability (in session "Storage and I/O")
Setting Up Basic Molecular Dynamics (MD) Calculations at CHPC Using DL_POLY Code” (in session "Thursday Workshop: Basic Molecular Dynamics Using DL_POLY")
South African Record Rainfalls (in session "Earth Science")
Speech by the Director-General, Department of Science & Technology (in session "Plenary")
Spin-transfer torque field switching of magnetization in vertically-stacked multilayers (in session "Material Science")
Striving to the End-User HPC Sweet Spot: Altair Perspective (in session "HPC")
STRUCTURE PROPERTY RELATIONSHIPS IN ORGANIC SOLAR CELLS MATERIALS (in session "Material Science")
Student Cluster Competition Awards (in session "Plenary")
Student Cyber Security Challenge Awards (in session "Plenary")
System administrator’s tools and techniques for user-facing software (in session "Sunday Workshop: System administrator’s tools and techniques for user-facing software")
Testing and Training Cybersecurity using a virtual platform (in session "SA NREN")
The Dawning of the Neo-Digital Age in the Era of Nano-Scale Technology (in session "Plenary")
The degradation of phosphate derived ligands in hydrometallurgical solvent extraction (in session "Chemistry")
The Demand for High Performance Computing in Kenya: Special Interest Groups as vehicles for promoting research collaboration (in session "Plenary")
The enzymatic mechanism of Human Immunodeficiency Virus type 1 (HIV-1) protease: are we there yet? (in session "Chemistry")
The identification of highly potent peptide scaffolds for the treatment of hormone resistant prostate cancer (in session "Chemistry")
The three big challenges scientists are confronted with in today’s data driven research – data, intelligence and interaction. (in session "Plenary")
Towards A National Research Data Management Strategy for South African Universities (in session "DIRISA")
Transforming Artificial Intelligence into Business Advantage (in session "Plenary")
Trends in systems and how to get efficient performance (in session "HPC")
Tuning the electronic, magnetic and optical properties of 2D materials: Ab initio insights (in session "Material Science")
TVET Connectivity Project (in session "SA NREN")
Unconventional use of Intel XeonPHI Knights Landing (in session "HPC")
Understanding and Controlling Processor Affinity (in session "HPC")
Understanding rainfall distribution over the Drakensberg Mountain Range under weak synoptic conditions. (in session "Earth Science")
Using docking and molecular dynamics to design potent and selective anticancer, anti-osteoclastogenic and anti-malarial compounds (in session "Chemistry")
Using the Open Source CFD GUI in FreeCAD (in session "Thursday Workshop: Using the open source CFD GUI in FreeCAD")
Validation of the OSCAR-5 Code System against Experimental Data on Fuel Burnup and Material Activation in Research Reactors (in session "Material Science")
Welcome (in session "Plenary")
What infrastructure is necessary for successful research data management (RDM) at universities? (in session "DIRISA")
Will AI transform your research and software? (in session "Cognitive Computing and Machine Learning")
Women in High Performance Computing in South Africa (in session "Women in HPC BoF")
Your DNS, My DNS - National risk and DNS infrastructure (in session "SA NREN")
Include materials from selected contributions
