- 16 Jun, 2010 1 commit
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Peter Eastman authored
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- 12 Jun, 2010 2 commits
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John Chodera authored
Fixed same pressure unit conversion error in MonteCarloBarostatImpl.cpp that occurs in tests. Tests now pass.
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John Chodera authored
Fixed unit conversion bug in Monte Carlo barostat where pV work was being divided by a factor of AVOGADRO*1e-25 (kJ/mol)/(bar nm^3), rather than multiplied by it. Checking this bug in since Peter Eastman is on vacation; he should double-check the fix upon return.
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- 10 Jun, 2010 1 commit
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Peter Eastman authored
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- 09 Jun, 2010 3 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 07 Jun, 2010 4 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 04 Jun, 2010 2 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 03 Jun, 2010 2 commits
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Mark Friedrichs authored
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Peter Eastman authored
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- 02 Jun, 2010 4 commits
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Peter Eastman authored
Optimization to nonbonded forces: replaced divides by multiplies when applying periodic boundary conditions
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 01 Jun, 2010 5 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 29 May, 2010 1 commit
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Peter Eastman authored
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- 26 May, 2010 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 25 May, 2010 1 commit
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Peter Eastman authored
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- 24 May, 2010 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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- 21 May, 2010 9 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Peter Eastman authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 17 May, 2010 1 commit
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Peter Eastman authored
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