- 09 Jul, 2025 1 commit
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Peter Eastman authored
* Fixed bug in computing pressure (#4980) * Add function parsing to custom multiparticle force (#4986) * Merge pull request #4989 from epretti/fix-charmm-water-models Update CHARMM36 2024 and add water models --------- Co-authored-by:
Ezra Greenberg <120955867+egreenberg7@users.noreply.github.com> Co-authored-by:
Evan Pretti <pretti@stanford.edu>
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- 28 Apr, 2025 1 commit
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Peter Eastman authored
* Added computeCurrentPressure() to MonteCarloBarostat * Use instantaneous temperature to compute pressure * Added computeCurrentPressure() to MonteCarloAnisotropicBarostat * Added computeCurrentPressure() to MonteCarloMembraneBarostat * Fixed compilation error * Fixed error in typemap * Added documentation on computing pressure * Fixed CUDA compilation errors * Made test case more robust * Made a test case more robust * Added computeCurrentPressure() to MonteCarloFlexibleBarostat * Fixed compilation error * More documentation on computing pressure
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- 12 Jun, 2023 1 commit
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Peter Eastman authored
* Attempt at fixing errors with barostat * Missing ContextSelector
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- 30 Sep, 2021 1 commit
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Peter Eastman authored
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- 03 Mar, 2017 1 commit
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peastman authored
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- 13 Jan, 2017 1 commit
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peastman authored
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- 20 Feb, 2015 1 commit
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peastman authored
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- 03 Dec, 2014 1 commit
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peastman authored
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- 08 Jul, 2013 1 commit
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peastman authored
Platform specific header files get installed. This allows plugins to be built with just an OpenMM installation, not a full source tree.
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- 31 May, 2013 1 commit
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Lee-Ping authored
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- 29 May, 2013 1 commit
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Lee-Ping authored
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- 04 Jan, 2011 1 commit
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Peter Eastman authored
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- 03 Jan, 2011 1 commit
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Peter Eastman authored
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- 22 May, 2010 1 commit
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Peter Eastman authored
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- 14 May, 2010 1 commit
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Peter Eastman authored
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- 12 May, 2010 1 commit
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Peter Eastman authored
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