David M. Rogers

Publication Activity (10 Years)

Years Active: 2015-2024
Publications (10 Years): 17

Top Topics

Development Efforts

Top Venues

Comput. Sci. Eng.

J. Chem. Inf. Model.

Publications

Lois Curfman McInnes, Michael A. Heroux, David E. Bernholdt, Anshu Dubey, Elsa Gonsiorowski, Rinku Gupta, Osni Marques, J. David Moulton, Hai Ah Nam, Boyana Norris, Elaine M. Raybourn, James M. Willenbring, Ann S. Almgren, Roscoe A. Bartlett, Kita Cranfill, Stephen Fickas, Don Frederick, William F. Godoy, Patricia A. Grubel, Rebecca Hartman-Baker, Axel Huebl, Rose Lynch, Addi Malviya-Thakur, Reed Milewicz, Mark C. Miller, Miranda Mundt, Erik Palmer, Suzanne Parete-Koon, Megan Phinney, Katherine Riley, David M. Rogers, Benjamin H. Sims, Deborah Stevens, Gregory R. Watson
A Cast of Thousands: How the IDEAS Productivity Project Has Advanced Software Productivity and Sustainability. Comput. Sci. Eng. 26 (1) (2024)
Reuben D. Budiardja, Mark A. Berrill, Markus Eisenbach, Gustav R. Jansen, Wayne Joubert, Stephen Nichols, David M. Rogers, Arnold N. Tharrington, O. E. Bronson Messer
Ready for the Frontier: Preparing Applications for the World's First Exascale System. ISC (2023)
Lois Curfman McInnes, Michael A. Heroux, David E. Bernholdt, Anshu Dubey, Elsa Gonsiorowski, Rinku Gupta, Osni Marques, J. David Moulton, Hai Ah Nam, Boyana Norris, Elaine M. Raybourn, James M. Willenbring, Ann S. Almgren, Ross Bartlett, Kita Cranfill, Stephen Fickas, Don Frederick, William F. Godoy, Patricia Grubel, Rebecca Hartman-Baker, Axel Huebl, Rose Lynch, Addi Malviya-Thakur, Reed Milewicz, Mark C. Miller, Miranda Mundt, Erik Palmer, Suzanne Parete-Koon, Megan Phinney, Katherine Riley, David M. Rogers, Benjamin H. Sims, Deborah Stevens, Gregory R. Watson
A cast of thousands: How the IDEAS Productivity project has advanced software productivity and sustainability. CoRR (2023)
David M. Rogers
Three practical workflow schedulers for easy maximum parallelism. Softw. Pract. Exp. 53 (1) (2023)
Scott Atchley, Christopher Zimmer, John Lange, David E. Bernholdt, Verónica G. Melesse Vergara, Thomas Beck, Michael J. Brim, Reuben D. Budiardja, Sunita Chandrasekaran, Markus Eisenbach, Thomas M. Evans, Matthew Ezell, Nicholas Frontiere, Antigoni Georgiadou, Joe Glenski, Philipp Grete, Steven P. Hamilton, John Holmen, Axel Huebl, Daniel A. Jacobson, Wayne Joubert, Kim Mcmahon, Elia Merzari, Stan G. Moore, Andrew Myers, Stephen Nichols, Sarp Oral, Thomas Papatheodore, Danny Perez, David M. Rogers, Evan Schneider, Jean-Luc Vay, P. K. Yeung
Frontier: Exploring Exascale. SC (2023)
Jackson W. Burns, David M. Rogers
QuantumScents: Quantum-Mechanical Properties for 3.5k Olfactory Molecules. J. Chem. Inf. Model. 63 (23) (2023)
Sambit Das, Bikash Kanungo, Vishal Subramanian, Gourab Panigrahi, Phani Motamarri, David M. Rogers, Paul Zimmerman, Vikram Gavini
Large-Scale Materials Modeling at Quantum Accuracy: Ab Initio Simulations of Quasicrystals and Interacting Extended Defects in Metallic Alloys. SC (2023)
David Eberius, Philip C. Roth, David M. Rogers
Understanding Strong Scaling on GPUs Using Empirical Performance Saturation Size. P3HPC@SC (2022)
Addi Malviya-Thakur, David E. Bernholdt, William F. Godoy, Gregory R. Watson, Mathieu Doucet, Mark A. Coletti, David M. Rogers, Marshall T. McDonnell, Jay Jay Billings, Barney Maccabe
Research Software Engineering at Oak Ridge National Laboratory. Comput. Sci. Eng. 24 (5) (2022)
Sambit Das, Phani Motamarri, Vishal Subramanian, David M. Rogers, Vikram Gavini
DFT-FE 1.0: A massively parallel hybrid CPU-GPU density functional theory code using finite-element discretization. Comput. Phys. Commun. 280 (2022)
David M. Rogers
Three Practical Workflow Schedulers for Easy Maximum Parallelism. CoRR (2021)
Jens Glaser, Josh Vincent Vermaas, David M. Rogers, Jeff Larkin, Scott LeGrand, Swen Boehm, Matthew B. Baker, Aaron Scheinberg, Andreas F. Tillack, Mathialakan Thavappiragasam, Ada Sedova, Oscar R. Hernandez
High-throughput virtual laboratory for drug discovery using massive datasets. Int. J. High Perform. Comput. Appl. 35 (5) (2021)
Josh Vincent Vermaas, Ada Sedova, Matthew B. Baker, Swen Boehm, David M. Rogers, Jeff Larkin, Jens Glaser, Micholas Dean Smith, Oscar R. Hernandez, Jeremy C. Smith
Supercomputing Pipelines Search for Therapeutics Against COVID-19. Comput. Sci. Eng. 23 (1) (2021)
David M. Rogers
Protein Conformational States: A First Principles Bayesian Method. CoRR (2020)
Atanu Acharya, Rupesh Agarwal, Matthew B. Baker, Jérôme Baudry, Debsindhu Bhowmik, Swen Böhm, Kendall G. Byler, Sam Yen-Chi Chen, Leighton Coates, Connor J. Cooper, Omar Demerdash, Isabella Daidone, John D. Eblen, Sally R. Ellingson, Stefano Forli, Jens Glaser, James C. Gumbart, John Gunnels, Oscar R. Hernandez, Stephan Irle, D. W. Kneller, A. Kovalevsky, Jeffrey M. Larkin, Travis J. Lawrence, Scott LeGrand, Shih-Hsien Liu, Julie C. Mitchell, Gilchan Park, Jerry M. Parks, Anna Pavlova, Loukas Petridis, Duncan Poole, Line Pouchard, Arvind Ramanathan, David M. Rogers, Diogo Santos-Martins, Aaron Scheinberg, Ada Sedova, Y. Shen, Jeremy C. Smith, Micholas Dean Smith, Carlos Soto, Aristides Tsaris, Mathialakan Thavappiragasam, Andreas F. Tillack, Josh Vincent Vermaas, Van Quan Vuong, Junqi Yin, Shinjae Yoo, Mai Zahran, Laura Zanetti Polzi
Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19. J. Chem. Inf. Model. 60 (12) (2020)
David M. Rogers
Protein Conformational States - A First Principles Bayesian Method. Entropy 22 (11) (2020)
David M. Rogers
Efficient Primitives for Standard Tensor Linear Algebra. XSEDE (2016)
David M. Rogers
Towards a Direct, By-Need Evaluator for Dependently Typed Languages. CoRR (2015)