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tsoc
openmm
Commits
5587fac9
Commit
5587fac9
authored
Jul 11, 2013
by
Lee-Ping Wang
Browse files
Merge
https://github.com/SimTk/openmm
parents
7a55f02c
73882ac5
Changes
219
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20 changed files
with
28 additions
and
28 deletions
+28
-28
platforms/opencl/tests/TestOpenCLEwald.cpp
platforms/opencl/tests/TestOpenCLEwald.cpp
+1
-1
platforms/opencl/tests/TestOpenCLFFT.cpp
platforms/opencl/tests/TestOpenCLFFT.cpp
+5
-5
platforms/opencl/tests/TestOpenCLGBSAOBCForce.cpp
platforms/opencl/tests/TestOpenCLGBSAOBCForce.cpp
+1
-1
platforms/opencl/tests/TestOpenCLGBSAOBCForce2.cpp
platforms/opencl/tests/TestOpenCLGBSAOBCForce2.cpp
+1
-1
platforms/opencl/tests/TestOpenCLHarmonicAngleForce.cpp
platforms/opencl/tests/TestOpenCLHarmonicAngleForce.cpp
+1
-1
platforms/opencl/tests/TestOpenCLLangevinIntegrator.cpp
platforms/opencl/tests/TestOpenCLLangevinIntegrator.cpp
+1
-1
platforms/opencl/tests/TestOpenCLMonteCarloBarostat.cpp
platforms/opencl/tests/TestOpenCLMonteCarloBarostat.cpp
+1
-1
platforms/opencl/tests/TestOpenCLMultipleForces.cpp
platforms/opencl/tests/TestOpenCLMultipleForces.cpp
+1
-1
platforms/opencl/tests/TestOpenCLNonbondedForce.cpp
platforms/opencl/tests/TestOpenCLNonbondedForce.cpp
+1
-1
platforms/opencl/tests/TestOpenCLPeriodicTorsionForce.cpp
platforms/opencl/tests/TestOpenCLPeriodicTorsionForce.cpp
+1
-1
platforms/opencl/tests/TestOpenCLRBTorsionForce.cpp
platforms/opencl/tests/TestOpenCLRBTorsionForce.cpp
+1
-1
platforms/opencl/tests/TestOpenCLRandom.cpp
platforms/opencl/tests/TestOpenCLRandom.cpp
+4
-4
platforms/opencl/tests/TestOpenCLSort.cpp
platforms/opencl/tests/TestOpenCLSort.cpp
+3
-3
platforms/opencl/tests/TestOpenCLVariableLangevinIntegrator.cpp
...rms/opencl/tests/TestOpenCLVariableLangevinIntegrator.cpp
+1
-1
platforms/opencl/tests/TestOpenCLVariableVerletIntegrator.cpp
...forms/opencl/tests/TestOpenCLVariableVerletIntegrator.cpp
+1
-1
platforms/opencl/tests/TestOpenCLVerletIntegrator.cpp
platforms/opencl/tests/TestOpenCLVerletIntegrator.cpp
+1
-1
platforms/reference/include/CpuGBVI.h
platforms/reference/include/CpuGBVI.h
+1
-1
platforms/reference/include/CpuObc.h
platforms/reference/include/CpuObc.h
+0
-0
platforms/reference/include/GBVIParameters.h
platforms/reference/include/GBVIParameters.h
+1
-1
platforms/reference/include/ObcParameters.h
platforms/reference/include/ObcParameters.h
+1
-1
No files found.
platforms/opencl/tests/TestOpenCLEwald.cpp
View file @
5587fac9
...
...
@@ -42,7 +42,7 @@
#include "openmm/LangevinIntegrator.h"
#include "openmm/VerletIntegrator.h"
#include "openmm/internal/ContextImpl.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLFFT.cpp
View file @
5587fac9
...
...
@@ -34,11 +34,11 @@
*/
#include "openmm/internal/AssertionUtilities.h"
#include "
../src/
OpenCLArray.h"
#include "
../src/
OpenCLContext.h"
#include "
../src/
OpenCLFFT3D.h"
#include "
../src/
OpenCLSort.h"
#include "
../src/SimTKReference/
fftpack.h"
#include "OpenCLArray.h"
#include "OpenCLContext.h"
#include "OpenCLFFT3D.h"
#include "OpenCLSort.h"
#include "fftpack.h"
#include "sfmt/SFMT.h"
#include "openmm/System.h"
#include <iostream>
...
...
platforms/opencl/tests/TestOpenCLGBSAOBCForce.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/GBSAOBCForce.h"
#include "openmm/System.h"
#include "openmm/LangevinIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include "openmm/NonbondedForce.h"
#include <iostream>
...
...
platforms/opencl/tests/TestOpenCLGBSAOBCForce2.cpp
View file @
5587fac9
...
...
@@ -58,7 +58,7 @@
#include "openmm/internal/AssertionUtilities.h"
#include "openmm/Context.h"
#include "openmm/System.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "OpenMM.h"
#if TEST_PLATFORM == TEST_OPENCL_PLATFORM
...
...
platforms/opencl/tests/TestOpenCLHarmonicAngleForce.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/HarmonicAngleForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLLangevinIntegrator.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/LangevinIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLMonteCarloBarostat.cpp
View file @
5587fac9
...
...
@@ -42,7 +42,7 @@
#include "openmm/LangevinIntegrator.h"
#include "openmm/VerletIntegrator.h"
#include "sfmt/SFMT.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLMultipleForces.cpp
View file @
5587fac9
...
...
@@ -44,7 +44,7 @@
#include "openmm/RBTorsionForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLNonbondedForce.cpp
View file @
5587fac9
...
...
@@ -45,7 +45,7 @@
#include "openmm/internal/ContextImpl.h"
#include "OpenCLArray.h"
#include "OpenCLNonbondedUtilities.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLPeriodicTorsionForce.cpp
View file @
5587fac9
...
...
@@ -39,7 +39,7 @@
#include "openmm/PeriodicTorsionForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLRBTorsionForce.cpp
View file @
5587fac9
...
...
@@ -39,7 +39,7 @@
#include "openmm/RBTorsionForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLRandom.cpp
View file @
5587fac9
...
...
@@ -34,14 +34,14 @@
*/
#include "openmm/internal/AssertionUtilities.h"
#include "
../src/
OpenCLArray.h"
#include "
../src/
OpenCLContext.h"
#include "
../src/
OpenCLIntegrationUtilities.h"
#include "OpenCLArray.h"
#include "OpenCLContext.h"
#include "OpenCLIntegrationUtilities.h"
#include "openmm/System.h"
#include "openmm/Context.h"
#include "OpenCLPlatform.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
using
namespace
OpenMM
;
...
...
platforms/opencl/tests/TestOpenCLSort.cpp
View file @
5587fac9
...
...
@@ -34,9 +34,9 @@
*/
#include "openmm/internal/AssertionUtilities.h"
#include "
../src/
OpenCLArray.h"
#include "
../src/
OpenCLContext.h"
#include "
../src/
OpenCLSort.h"
#include "OpenCLArray.h"
#include "OpenCLContext.h"
#include "OpenCLSort.h"
#include "sfmt/SFMT.h"
#include "openmm/System.h"
#include <iostream>
...
...
platforms/opencl/tests/TestOpenCLVariableLangevinIntegrator.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/VariableLangevinIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLVariableVerletIntegrator.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/VariableVerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/opencl/tests/TestOpenCLVerletIntegrator.cpp
View file @
5587fac9
...
...
@@ -40,7 +40,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/
src/gbsa
/CpuGBVI.h
→
platforms/reference/
include
/CpuGBVI.h
View file @
5587fac9
...
...
@@ -27,7 +27,7 @@
#include <vector>
#include "
../SimTKUtilities/
RealVec.h"
#include "RealVec.h"
#include "GBVIParameters.h"
// ---------------------------------------------------------------------------------------
...
...
platforms/reference/
src/gbsa
/CpuObc.h
→
platforms/reference/
include
/CpuObc.h
View file @
5587fac9
File moved
platforms/reference/
src/gbsa
/GBVIParameters.h
→
platforms/reference/
include
/GBVIParameters.h
View file @
5587fac9
...
...
@@ -25,7 +25,7 @@
#ifndef __GBVIParameters_H__
#define __GBVIParameters_H__
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "SimTKOpenMMCommon.h"
// ---------------------------------------------------------------------------------------
...
...
platforms/reference/
src/gbsa
/ObcParameters.h
→
platforms/reference/
include
/ObcParameters.h
View file @
5587fac9
...
...
@@ -25,7 +25,7 @@
#ifndef __ObcParameters_H__
#define __ObcParameters_H__
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "SimTKOpenMMCommon.h"
// ---------------------------------------------------------------------------------------
...
...
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