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The General Atomic and Molecular Electronic Structure System (GAMESS): Novel Methods on Novel Architectures Zahariev, Federico; Xu, Peng; Westheimer, Bryce M.; Webb, Simon; Galvez Vallejo, Jorge; Tiwari, Ananta; Sundriyal, Vaibhav; Sosonkina, Masha; Shen, Jun; Schoendorff, George; Schlinsog, Megan; Sattasathuchana, Tosaporn; Ruedenberg, Klaus; Roskop, Luke B.; Rendell, Alistair P.; Poole, David; Piecuch, Piotr; Pham, Buu Q.; Mironov, Vladimir; Mato, Joani; Leonard, Sam; Leang, Sarom S.; Ivanic, Joe; Hayes, Jackson; Harville, Taylor; Gururangan, Karthik; Guidez, Emilie; Gerasimov, Igor S.; Friedl, Christian; Ferreras, Katherine N.; Elliott, George; Datta, Dipayan; Cruz, Daniel Del Angel; Carrington, Laura; Bertoni, Colleen; Barca, Giuseppe M. J.; Alkan, Melisa; Gordon, Mark S. Share Save
Toward an extreme-scale electronic structure system Vallejo, Jorge L. Galvez; Snowdon, Calum; Stocks, Ryan; Kazemian, Fazeleh; Yu, Fiona Chuo Yan; Seidl, Christopher; Seeger, Zoe; Alkan, Melisa; Poole, David; Westheimer, Bryce M.; Basha, Mehaboob; De La Pierre, Marco; Rendell, Alistair; Izgorodina, Ekaterina I.; Gordon, Mark S.; Barca, Giuseppe M. J. Share Save
A Deep Learning Network for Classifying Arteries and Veins in Montaged Widefield OCT Angiograms Gao, Min; Guo, Yukun; Hormel, Tristan T.; Tsuboi, Kotaro; Pacheco, George; Poole, David; Bailey, Steven T.; Flaxel, Christina J.; Huang, David; Hwang, Thomas S.; Jia, Yali Share Save
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Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19 Acharya, A.; Agarwal, R.; Baker, M. B.; Baudry, J.; Bhowmik, D.; Boehm, S.; Byler, K. G.; Chen, S. Y.; Coates, L.; Cooper, C. J.; Demerdash, O.; Daidone, I; Eblen, J. D.; Ellingson, S.; Forli, S.; Glaser, J.; Gumbart, J. C.; Gunnels, J.; Hernandez, O.; Irle, S.; Kneller, D. W.; Kovalevsky, A.; Larkin, J.; Lawrence, T. J.; LeGrand, S.; Liu, S-H; Mitchell, J. C.; Park, G.; Parks, J. M.; Pavlova, A.; Petridis, L.; Poole, D.; Pouchard, L.; Ramanathan, A.; Rogers, D. M.; Santos-Martins, D.; Scheinberg, A.; Sedova, A.; Shen, Y.; Smith, J. C.; Smith, M. D.; Soto, C.; Tsaris, A.; Thavappiragasam, M.; Tillack, A. F.; Vermaas, J. V.; Vuong, V. Q.; Yin, J.; Yoo, S.; Zahran, M.; Zanetti-Polzi, L. Share Save
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Recent developments in the general atomic and molecular electronic structure system Barca, Giuseppe M. J.; Bertoni, Colleen; Carrington, Laura; Datta, Dipayan; De Silva, Nuwan; Deustua, J. Emiliano; Fedorov, Dmitri G.; Gour, Jeffrey R.; Gunina, Anastasia O.; Guidez, Emilie; Harville, Taylor; Irle, Stephan; Ivanic, Joe; Kowalski, Karol; Leang, Sarom S.; Li, Hui; Li, Wei; Lutz, Jesse J.; Magoulas, Ilias; Mato, Joani; Mironov, Vladimir; Nakata, Hiroya; Pham, Buu Q.; Piecuch, Piotr; Poole, David; Pruitt, Spencer R.; Rendell, Alistair P.; Roskop, Luke B.; Ruedenberg, Klaus; Sattasathuchana, Tosaporn; Schmidt, Michael W.; Shen, Jun; Slipchenko, Lyudmila; Sosonkina, Masha; Sundriyal, Vaibhav; Tiwari, Ananta; Vallejo, Jorge L. Galvez; Westheimer, Bryce; Wloch, Marta; Xu, Peng; Zahariev, Federico; Gordon, Mark S. Share Save
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