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Afibuzzaman, Md afibuzza
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Aktulga, H. Metin hma
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Alperen, Abdullah alperena
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Betancourt, William betanc18
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Dikbayir, Doga dikbayir
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Kaymak, Cagri kaymakme
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Kurt A. O'Hearn ohearnku
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Lingg, Michael linggmic
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Rabbi, Fazlay
rabbimd
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Rahnamoun, Ali rahnamou
- Feb 04, 2018
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Kurt A. O'Hearn authored
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- Jan 26, 2018
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Kurt A. O'Hearn authored
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- Jan 08, 2018
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Kurt A. O'Hearn authored
sPuReMD: split into library and driver for, e.g., optimization integration. Fix bug with interaction lists being allocated for hydrogen bonds when no hydorgen atoms present. Fix minimum allocation size of 3-body lists (uncovered with small lithium geometries). Refactor naming of conflicting data structures. Update .gitignore.
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- Sep 10, 2017
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Kurt A. O'Hearn authored
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- Aug 22, 2017
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Kurt A. O'Hearn authored
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- Jul 24, 2017
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Kurt A. O'Hearn authored
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- Jun 17, 2017
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Kurt A. O'Hearn authored
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- May 26, 2017
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Kurt A. O'Hearn authored
PG-PuReMD: begin enhancements. Enable sim. step retries. Enable far neighbors list max per atom. Other general code clean-ups.
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- Dec 06, 2016
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Kurt A. O'Hearn authored
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- Jun 28, 2016
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Kurt A. O'Hearn authored
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- Jun 12, 2016
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Kurt A. O'Hearn authored
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- Jun 09, 2016
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Kurt A. O'Hearn authored
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- May 16, 2016
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Kurt A. O'Hearn authored
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- Apr 23, 2016
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Kurt A. O'Hearn authored
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- Feb 24, 2016
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Kurt A. O'Hearn authored
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- Jan 14, 2016
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Kurt A. O'Hearn authored
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