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Mathialakan Thavappiragasam
Mathialakan Thavappiragasam
Postdoctoral Appointee Argonne National Lab
Verified email at ornl.gov
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Cited by
Cited by
Year
Supercomputer-based ensemble docking drug discovery pipeline with application to COVID-19
A Acharya, R Agarwal, MB Baker, J Baudry, D Bhowmik, S Boehm, ...
Journal of chemical information and modeling 60 (12), 5832-5852, 2020
1562020
GPU-accelerated drug discovery with docking on the summit supercomputer: Porting, optimization, and application to COVID-19 research
S LeGrand, A Scheinberg, AF Tillack, M Thavappiragasam, JV Vermaas, ...
Proceedings of the 11th ACM international conference on bioinformatics …, 2020
692020
High-throughput virtual laboratory for drug discovery using massive datasets
J Glaser, JV Vermaas, DM Rogers, J Larkin, S LeGrand, S Boehm, ...
The International Journal of High Performance Computing Applications 35 (5 …, 2021
382021
Addressing load imbalance in bioinformatics and biomedical applications: Efficient scheduling across multiple gpus
M Thavappiragasam, V Kale, O Hernandez, A Sedova
2021 IEEE International Conference on Bioinformatics and Biomedicine (BIBM …, 2021
72021
Performance Portability of Molecular Docking Miniapp On Leadership Computing Platforms
M Thavappiragasam, A Scheinberg, W Elwasif, O Hernandez, A Sedova
2020 IEEE/ACM International Workshop on Performance, Portability and …, 2020
52020
Graphics processing unit computations for finite element optimization: A review and some issues to be addressed
S Sivamayam, K Victor U, M Thavappiragasam, R Mohammad R, ...
Revue Roumaine Des Sci. Techn.-Serie ElectrotechniQque Et Energetique 60 (3 …, 2015
42015
Automatic biosystems comparison using semantic and name similarity
M Thavappiragasam, CM Lushbough, EZ Gnimpieba
Proceedings of the 5th ACM Conference on Bioinformatics, Computational …, 2014
42014
Portability for GPU-accelerated molecular docking applications for cloud and HPC: can portable compiler directives provide performance across all platforms?
M Thavappiragasam, W Elwasif, A Sedova
2022 22nd IEEE International Symposium on Cluster, Cloud and Internet …, 2022
32022
Parallel Algorithms for Successive Convolution
AJ Christlieb, PT Guthrey, WA Sands, M Thavappiragasm
Journal of Scientific Computing 86 (1), 2020
32020
A fast local embedded boundary method suitable for high power electromagnetic sources
M Thavappiragasam, A Christlieb, J Luginsland, P Guthrey
AIP Advances 10 (11), 115318, 2020
32020
MOLT based fast high-order three dimensional A-stable scheme for wave propagation
M Thavappiragasam, A Viswanathan, A Christlieb
Journal of Coupled Systems and Multiscale Dynamics 5 (3), 151-163, 2017
32017
SBMLDock: Docker Driven Systems Biology Tool Development and Usage
EZ Gnimpieba, M Thavappiragasam, A Chango, B Conn, CM Lushbough
International Conference on Computational Methods in Systems Biology 9308 …, 2015
32015
Coil positioning for defect reconstruction in a steel plate
K Victor U, M Thavappiragsam, J Paramsothy, T Ravi S, H SRH
2015 31st International Review of Progress in Applied Computational …, 2015
3*2015
The Depth Limits of Eddy Current Testing for Defects: A Computational Investigation and Smooth-Shaped Defect Synthesis from Finite Element Optimization
M Thavappiragasam, VU Karthik, P Jayakumar, R Thyagarajan, ...
SAE International Journal of Materials and Manufacturing 8 (2), 450-457, 2015
22015
Expert System and Semantic Web Knowledge Base for Low Frequency Electromagnetic Devices
M Thavappiragasam, SRH Hoole
Journal of Computational Intelligence and Electronic Systems 3 (04), 312–316, 2014
2*2014
Modeling protein structures from predicted contacts with modern molecular dynamics potentials: accuracy, sensitivity, and refinement
RB Davidson, M Thavappiragasam, TC Effler, J Woods, DA Elias, ...
Proceedings of the 12th ACM Conference on Bioinformatics, Computational …, 2021
12021
Using Python for Improved Productivity in HPC and Data Science Applications: the Time is Now
J Woods, M Baker, M Thavappiragasam, A Sedova, O Hernandez, ...
2020 Collegeville Workshop on Scientific Software, 2020
12020
A-Stable Implicit Rapid Scheme and Software Solution for Electromagnetic Wave Propagation
M Thavappiragsam
Michigan State University, ProQuest Dissertations Publishing, 2019
12019
Heuristic parallelizable algorithm for similarity based biosystems comparison
M Thavappiragasam, CM Lushbough, EZ Gnimpieba
Proceedings of the 5th ACM Conference on Bioinformatics, Computational …, 2014
12014
OpenMP’s Asynchronous Offloading for All-pairs Shortest Path Graph Algorithms on GPUs
M Thavappiragasam, V Kale
2022 IEEE/ACM International Workshop on Hierarchical Parallelism for …, 2022
2022
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