"...reference/include/AmoebaReferenceKernelFactory.h" did not exist on "0e879806cdd38e58b04481ecf7fcd93c44c7dc27"
- 12 Jan, 2017 1 commit
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peastman authored
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- 17 Oct, 2016 1 commit
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jchodera authored
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Peter Eastman authored
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peastman authored
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peastman authored
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Peter Eastman authored
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Peter Eastman authored
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peastman authored
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Peter Eastman authored
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peastman authored
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- 11 Mar, 2016 1 commit
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peastman authored
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- 06 Feb, 2016 1 commit
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John Chodera (MSKCC) authored
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- 27 Jan, 2016 1 commit
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Nate Stanley authored
different platforms and OpenMM versions, while Checkpoint files can not be exchanged between platforms or versions of Openmm.
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- 21 Jan, 2016 4 commits
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John Chodera (MSKCC) 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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John Chodera (MSKCC) authored
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John Chodera (MSKCC) authored
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- 03 Jan, 2016 1 commit
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John Chodera (MSKCC) authored
Added documentation of residue template generator with admonition that feature is experimental and API is subject to change.
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- 14 Dec, 2015 1 commit
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Robert McGibbon authored
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- 21 Nov, 2015 1 commit
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Nate Stanley authored
and progress. Also added a small note about the determinism of simulations on different platforms.
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Peter Eastman authored
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- 11 Nov, 2015 1 commit
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Peter Eastman authored
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Peter Eastman authored
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peastman authored
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peastman authored
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peastman authored
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peastman authored
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peastman authored
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Chodera authored
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peastman authored
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- 19 Jun, 2015 2 commits
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Jason Swails authored
This should be *lower* than that of Unit (and ScaledUnit/BaseUnit), since we still want Units to take priority over Quantities (but Quantity to take precedence over regular ndarrays) for reasons like this: >>> a = np.array([1]) * u.angstroms >>> b = a * u.angstroms # should be np.array([1])*u.angstroms**2 >>> np.arange(10) * a # utilize broadcasting [1 2 3 4 5 6 7 8 9 10] A**2
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Jason Swails authored
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- 12 Jun, 2015 1 commit
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peastman authored
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- 19 May, 2015 1 commit
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peastman authored
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- 06 May, 2015 1 commit
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Peter Eastman authored
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