- Feb 20, 2019
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Kurt A. O'Hearn authored
Fix build issue where config.h.in is only generated once (for sPuReMD) => common file across all versions.
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- Feb 06, 2019
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Kurt A. O'Hearn authored
Build toos: refactor to remove recurisve Makefiles. Fix issue with OpenMP flags being overridden when user supplied value for CFLAGS variable.
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- Nov 06, 2018
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Kurt A. O'Hearn authored
Build systems updates for sPuReMD, PuReMD-GPU, and PG-PuReMD (use safer optimization level defaults).
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- Mar 12, 2018
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Kurt A. O'Hearn authored
All: fix issue with pi bonds being incorrectly computed in bond orders. Patch originally submitted to LAMMPS mailing list by Tomas Trnka, SCM (refer to Issue #837 on Github).
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- Dec 08, 2016
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Kurt A. O'Hearn authored
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Kurt A. O'Hearn authored
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- Dec 06, 2016
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Kurt A. O'Hearn authored
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- Dec 05, 2016
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Kurt A. O'Hearn authored
PuReMD-GPU: fix issues with C++ to C calling conventions. Remove function overloading for C compilation.
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- Dec 03, 2016
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KAO authored
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- Nov 25, 2016
- Nov 24, 2016
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KAO authored
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- Nov 22, 2016
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Kurt A. O'Hearn authored
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- Sep 07, 2016
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Kurt A. O'Hearn authored
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Kurt A. O'Hearn authored
sPuReMD: fix incorrect thread parallelism inside bonded force routines. Update default value of CFLAGS in autotools.
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- Sep 06, 2016
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Kurt A. O'Hearn authored
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- Jul 25, 2016
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Kurt A. O'Hearn authored
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- Jun 20, 2016
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Kurt A. O'Hearn authored
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Kurt A. O'Hearn authored
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- Jun 18, 2016
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Kurt A. O'Hearn authored
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