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Commits on May 7, 2012

• Implemented delta() for custom expressions

  peastman

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Commits on Jan 31, 2012

• Added index bounds checking to lots of methods

  peastman

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Commits on Sep 19, 2011

• Minor optimizations to custom forces

  peastman

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Commits on Jul 16, 2010

• Debug new spline code on Windows

  

  Christopher Bruns

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Commits on Jul 15, 2010

• Created SplineFitter

  peastman

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Commits on Jul 13, 2010

• LocalEnergyMinimizer works with constraints. Also added Context::applyConstraints().

  peastman

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Commits on Jul 9, 2010

• Created LocalEnergyMinimizer

  peastman

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Commits on Apr 20, 2010

• Started making some improvements to installer behavior.

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  Christopher Bruns

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Commits on Apr 16, 2010

• min(), max(), and abs() can appear in expressions

  peastman

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Commits on Mar 9, 2010

• Changed std::fabs to std::abs in AssertionUtilities.h to avoid compile ambiguity error on Windows with TestReferenceCustomHbondForce

  

  Christopher Bruns

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Commits on Feb 11, 2010

• Test cases which may occasionally fail say so in the error message.

  peastman

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Commits on Jan 5, 2010

• erf() and erfc() can appear in expressions

  peastman

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Commits on Dec 10, 2009

• Optimizations to expression processing in CustomGBForce

  peastman

  committed
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Commits on Nov 24, 2009

• Added some optimizations

  peastman

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Commits on Nov 19, 2009

• Implemented step function in custom expressions

  peastman

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Commits on Nov 11, 2009

• Added support for subexpressions

  peastman

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Commits on Nov 4, 2009

• Minor code simplification

  peastman

  committed
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Commits on Nov 3, 2009

• Added support for sinh(), cosh(), and tanh() functions.

  peastman

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Commits on Oct 30, 2009

• Added test case for Parser

  peastman

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Commits on Jul 7, 2009

• Added a "replace" flag to NonbondedForce::addException()

  peastman

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Commits on Apr 23, 2009

• (1) Fixed more VC++ warnings; this is almost clean now.

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  sherm1

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Commits on Apr 21, 2009

• Moved header files into an openmm subdirectory

  peastman

  committed
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Commits on Apr 17, 2009

• Redesigned the API for specifying exclusions and 1-4 interactions.

  peastman

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Commits on Oct 22, 2008

• Split StandardMMForceField into separate classes for each force term.

  peastman

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Commits on Oct 16, 2008

• Changed how kernels get initialized. StandardMMForceField now has you set the 1-4 interactions explicitly. CMMotionRemover allows the removal frequency to be set.

  peastman

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Commits on Oct 15, 2008

• Finished incorporating Cuda code into OpenMM

  peastman

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Commits on Jul 12, 2008

• Implemented cutoffs and periodic boundary conditions for reference platform

  peastman

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Commits on Jun 23, 2008

• Created platform-generic versions of the test of the ReferencePlatform test programs.

  

  Christopher Bruns

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• Converted two more ReferencePlatform tests to platform generic tests

  

  Christopher Bruns

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• Many changes to build OpenMM on Windows:

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  Christopher Bruns

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Commits on Jun 12, 2008

• Attempt to address some windows nightly build errors

  

  Christopher Bruns

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Commits on Jun 11, 2008

• Debugged memory corruption in TestFindExclusions

  

  Christopher Bruns

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• Created platform generic AndersenThermostat test

  

  Christopher Bruns

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Commits on Jun 4, 2008

• Began implementing CudaPlatform

  peastman

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Commits on Apr 29, 2008

• Created reference implementation of VerletIntegrator

  peastman

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