The scalable heterogeneous computing (SHOC) benchmark suite A Danalis, G Marin, C McCurdy, JS Meredith, PC Roth, K Spafford, ... Proceedings of the 3rd Workshop on General-Purpose Computation on Graphics …, 2010 | 676 | 2010 |
NWChem, A computational chemistry package for parallel computers, version 5.1 EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 0999, 2007 | 531 | 2007 |
Advances, applications and performance of the global arrays shared memory programming toolkit J Nieplocha, B Palmer, V Tipparaju, M Krishnan, H Trease, E Apra The International Journal of High Performance Computing Applications 20 (2 …, 2006 | 404 | 2006 |
NWCHEM, a computational chemistry package for parallel computers, Version 4.6 TP Straatsma, E Apra, TL Windus, EJ Bylaska, W de Jong, S Hirata, ... Pacific Northwest National Laboratory, Richland, Washington, 99352-0999, 2004 | 227 | 2004 |
Nwchem, a computational chemistry package for parallel computers, version 4.7 E Apra, TL Windus, TP Straatsma, EJ Bylaska, W de Jong, S Hirata, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 2005 | 205 | 2005 |
High performance remote memory access communication: The ARMCI approach J Nieplocha, V Tipparaju, M Krishnan, DK Panda The International Journal of High Performance Computing Applications 20 (2 …, 2006 | 144 | 2006 |
Fast collective operations using shared and remote memory access protocols on clusters V Tipparaju, J Nieplocha, D Panda Proceedings International Parallel and Distributed Processing Symposium, 10 pp., 2003 | 119 | 2003 |
Host-assisted zero-copy remote memory access communication on infiniband V Tipparaju, G Santhanaraman, J Nieplocha, OK Panda 18th International Parallel and Distributed Processing Symposium, 2004 …, 2004 | 67 | 2004 |
Liquid water: obtaining the right answer for the right reasons E Apra, AP Rendell, RJ Harrison, V Tipparaju, WA deJong, SS Xantheas Proceedings of the conference on high performance computing networking …, 2009 | 66 | 2009 |
Computational Chemistry Package for Parallel Computers TL Windus, S Hirata, MT Hackler, Y Zhao, PD Fan, RJ Harrison, M Dupuis, ... Version, 2006 | 62 | 2006 |
Supporting the global arrays PGAS model using MPI one-sided communication J Dinan, P Balaji, JR Hammond, S Krishnamoorthy, V Tipparaju 2012 IEEE 26th International Parallel and Distributed Processing Symposium …, 2012 | 53 | 2012 |
Scalable implementations of accurate excited-state coupled cluster theories: Application of high-level methods to porphyrin-based systems K Kowalski, S Krishnamoorthy, RM Olson, V Tipparaju, E Apra Proceedings of 2011 International Conference for High Performance Computing …, 2011 | 44 | 2011 |
NWChem EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, ... A Computational Chemistry Package for Parallel Computers, Version 5 (1), 2007 | 44 | 2007 |
NWChem: Past, present, and future E Apra, EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, ... The Journal of chemical physics 152 (18), 184102, 2020 | 35 | 2020 |
Noncollective communicator creation in MPI J Dinan, S Krishnamoorthy, P Balaji, JR Hammond, M Krishnan, ... European MPI Users' Group Meeting, 282-291, 2011 | 32 | 2011 |
Investigating high performance RMA interfaces for the MPI-3 standard V Tipparaju, W Gropp, H Ritzdorf, R Thakur, JL Traff 2009 International Conference on Parallel Processing, 293-300, 2009 | 29 | 2009 |
Efficient barrier using remote memory operations on VIA-based clusters R Gupta, V Tipparaju, J Nieplocha, D Panda Proceedings. IEEE International Conference on Cluster Computing, 83-90, 2002 | 28 | 2002 |
The Use of Processor Groups in Molecular Dynamics Simulations to Sample Free-Energy States B Palmer, S Kathmann, M Krishnan, V Tipparaju, J Nieplocha Journal of chemical theory and computation 3 (2), 583-592, 2007 | 27 | 2007 |
Transparent system-level migration of PGAS applications using Xen on InfiniBand DP Scarpazza, P Mullaney, O Villa, F Petrini, V Tipparaju, DML Brown, ... 2007 IEEE International Conference on Cluster Computing, 74-83, 2007 | 25 | 2007 |
Exploiting non-blocking remote memory access communication in scientific benchmarks V Tipparaju, M Krishnan, J Nieplocha, G Santhanaraman, D Panda International Conference on High-Performance Computing, 248-258, 2003 | 25 | 2003 |