- 20 Jan, 2016 2 commits
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Rafal P. Wiewiora authored
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Rafal P. Wiewiora authored
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- 19 Jan, 2016 1 commit
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jchodera authored
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- 14 Jan, 2016 1 commit
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Peter Eastman authored
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- 09 Jan, 2016 2 commits
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Rafal P. Wiewiora authored
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Rafal P. Wiewiora authored
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- 02 Jan, 2016 12 commits
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
Fix alanine dipeptide example by including CRYST record in explicit; add .inpcrd files for explicit and implicit.
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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- 01 Jan, 2016 3 commits
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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- 12 Dec, 2015 1 commit
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Robert T. McGibbon authored
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- 20 Nov, 2015 1 commit
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Jason Swails authored
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- 07 Nov, 2015 1 commit
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Peter Eastman authored
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- 06 Nov, 2015 1 commit
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Peter Eastman authored
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- 03 Nov, 2015 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 30 Oct, 2015 1 commit
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Robert McGibbon authored
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- 27 Oct, 2015 1 commit
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Robert McGibbon authored
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- 26 Oct, 2015 8 commits
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Robert McGibbon authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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- 09 Oct, 2015 2 commits
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peastman authored
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Jason Swails authored
Add relevant tests (that used to fail). This also fixes a subtle bug where switching functions were not applied when NBFIXes were specified.
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- 07 Oct, 2015 1 commit
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M J Harvey authored
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