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tsoc
openmm
Commits
e3b25204
Commit
e3b25204
authored
Jul 15, 2013
by
leeping
Browse files
Merge github.com:leeping/openmm
parents
41e9a095
74415dd9
Changes
295
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20 changed files
with
34 additions
and
34 deletions
+34
-34
platforms/reference/src/SimTKReference/ReferenceRbDihedralBond.cpp
.../reference/src/SimTKReference/ReferenceRbDihedralBond.cpp
+3
-3
platforms/reference/src/SimTKReference/ReferenceShakeAlgorithm.cpp
.../reference/src/SimTKReference/ReferenceShakeAlgorithm.cpp
+3
-3
platforms/reference/src/SimTKReference/ReferenceStochasticDynamics.cpp
...erence/src/SimTKReference/ReferenceStochasticDynamics.cpp
+3
-3
platforms/reference/src/SimTKReference/ReferenceVariableStochasticDynamics.cpp
...rc/SimTKReference/ReferenceVariableStochasticDynamics.cpp
+3
-3
platforms/reference/src/SimTKReference/ReferenceVariableVerletDynamics.cpp
...ce/src/SimTKReference/ReferenceVariableVerletDynamics.cpp
+3
-3
platforms/reference/src/SimTKReference/ReferenceVerletDynamics.cpp
.../reference/src/SimTKReference/ReferenceVerletDynamics.cpp
+3
-3
platforms/reference/src/gbsa/CpuGBVI.cpp
platforms/reference/src/gbsa/CpuGBVI.cpp
+2
-2
platforms/reference/src/gbsa/CpuObc.cpp
platforms/reference/src/gbsa/CpuObc.cpp
+2
-2
platforms/reference/src/gbsa/GBVIParameters.cpp
platforms/reference/src/gbsa/GBVIParameters.cpp
+1
-1
platforms/reference/src/gbsa/ObcParameters.cpp
platforms/reference/src/gbsa/ObcParameters.cpp
+1
-1
platforms/reference/tests/TestReferenceAndersenThermostat.cpp
...forms/reference/tests/TestReferenceAndersenThermostat.cpp
+1
-1
platforms/reference/tests/TestReferenceBrownianIntegrator.cpp
...forms/reference/tests/TestReferenceBrownianIntegrator.cpp
+1
-1
platforms/reference/tests/TestReferenceCMAPTorsionForce.cpp
platforms/reference/tests/TestReferenceCMAPTorsionForce.cpp
+1
-1
platforms/reference/tests/TestReferenceCMMotionRemover.cpp
platforms/reference/tests/TestReferenceCMMotionRemover.cpp
+1
-1
platforms/reference/tests/TestReferenceCustomBondForce.cpp
platforms/reference/tests/TestReferenceCustomBondForce.cpp
+1
-1
platforms/reference/tests/TestReferenceCustomExternalForce.cpp
...orms/reference/tests/TestReferenceCustomExternalForce.cpp
+1
-1
platforms/reference/tests/TestReferenceCustomIntegrator.cpp
platforms/reference/tests/TestReferenceCustomIntegrator.cpp
+1
-1
platforms/reference/tests/TestReferenceEwald.cpp
platforms/reference/tests/TestReferenceEwald.cpp
+1
-1
platforms/reference/tests/TestReferenceGBSAOBCForce.cpp
platforms/reference/tests/TestReferenceGBSAOBCForce.cpp
+1
-1
platforms/reference/tests/TestReferenceGBVIForce.cpp
platforms/reference/tests/TestReferenceGBVIForce.cpp
+1
-1
No files found.
platforms/reference/src/SimTKReference/ReferenceRbDihedralBond.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <string.h>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMLog.h"
#include "SimTKOpenMMUtilities.h"
#include "ReferenceRbDihedralBond.h"
#include "ReferenceForce.h"
...
...
platforms/reference/src/SimTKReference/ReferenceShakeAlgorithm.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <string.h>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMUtilities.h"
#include "SimTKOpenMMLog.h"
#include "ReferenceShakeAlgorithm.h"
#include "ReferenceDynamics.h"
#include "openmm/OpenMMException.h"
...
...
platforms/reference/src/SimTKReference/ReferenceStochasticDynamics.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <cstring>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMLog.h"
#include "SimTKOpenMMUtilities.h"
#include "ReferenceStochasticDynamics.h"
#include "ReferenceVirtualSites.h"
...
...
platforms/reference/src/SimTKReference/ReferenceVariableStochasticDynamics.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <cstring>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMLog.h"
#include "SimTKOpenMMUtilities.h"
#include "ReferenceVariableStochasticDynamics.h"
#include "ReferenceVirtualSites.h"
...
...
platforms/reference/src/SimTKReference/ReferenceVariableVerletDynamics.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <string.h>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMLog.h"
#include "SimTKOpenMMUtilities.h"
#include "ReferenceVariableVerletDynamics.h"
#include "ReferenceVirtualSites.h"
...
...
platforms/reference/src/SimTKReference/ReferenceVerletDynamics.cpp
View file @
e3b25204
...
...
@@ -25,9 +25,9 @@
#include <cstring>
#include <sstream>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKUtilities/
SimTKOpenMMLog.h"
#include "
../SimTKUtilities/
SimTKOpenMMUtilities.h"
#include "SimTKOpenMMCommon.h"
#include "SimTKOpenMMLog.h"
#include "SimTKOpenMMUtilities.h"
#include "ReferenceVerletDynamics.h"
#include "ReferenceVirtualSites.h"
...
...
platforms/reference/src/gbsa/CpuGBVI.cpp
View file @
e3b25204
...
...
@@ -26,8 +26,8 @@
#include <sstream>
#include <stdio.h>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKReference/
ReferenceForce.h"
#include "SimTKOpenMMCommon.h"
#include "ReferenceForce.h"
#include "CpuGBVI.h"
using
namespace
std
;
...
...
platforms/reference/src/gbsa/CpuObc.cpp
View file @
e3b25204
...
...
@@ -28,8 +28,8 @@
#include <cmath>
#include <cstdio>
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "
../SimTKReference/
ReferenceForce.h"
#include "SimTKOpenMMCommon.h"
#include "ReferenceForce.h"
#include "CpuObc.h"
using
namespace
OpenMM
;
...
...
platforms/reference/src/gbsa/GBVIParameters.cpp
View file @
e3b25204
...
...
@@ -28,7 +28,7 @@
#include "openmm/OpenMMException.h"
#include "GBVIParameters.h"
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "SimTKOpenMMCommon.h"
using
std
::
vector
;
using
OpenMM
::
RealVec
;
...
...
platforms/reference/src/gbsa/ObcParameters.cpp
View file @
e3b25204
...
...
@@ -28,7 +28,7 @@
#include "openmm/OpenMMException.h"
#include "ObcParameters.h"
#include "
../SimTKUtilities/
SimTKOpenMMCommon.h"
#include "SimTKOpenMMCommon.h"
using
std
::
vector
;
...
...
platforms/reference/tests/TestReferenceAndersenThermostat.cpp
View file @
e3b25204
...
...
@@ -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/tests/TestReferenceBrownianIntegrator.cpp
View file @
e3b25204
...
...
@@ -40,7 +40,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/BrownianIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/tests/TestReferenceCMAPTorsionForce.cpp
View file @
e3b25204
...
...
@@ -40,7 +40,7 @@
#include "openmm/PeriodicTorsionForce.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/tests/TestReferenceCMMotionRemover.cpp
View file @
e3b25204
...
...
@@ -41,7 +41,7 @@
#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/tests/TestReferenceCustomBondForce.cpp
View file @
e3b25204
...
...
@@ -39,7 +39,7 @@
#include "openmm/CustomBondForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/tests/TestReferenceCustomExternalForce.cpp
View file @
e3b25204
...
...
@@ -39,7 +39,7 @@
#include "openmm/CustomExternalForce.h"
#include "openmm/System.h"
#include "openmm/VerletIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/tests/TestReferenceCustomIntegrator.cpp
View file @
e3b25204
...
...
@@ -41,7 +41,7 @@
#include "openmm/NonbondedForce.h"
#include "openmm/System.h"
#include "openmm/CustomIntegrator.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/tests/TestReferenceEwald.cpp
View file @
e3b25204
...
...
@@ -39,7 +39,7 @@
#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 "openmm/HarmonicBondForce.h"
#include <iostream>
...
...
platforms/reference/tests/TestReferenceGBSAOBCForce.cpp
View file @
e3b25204
...
...
@@ -40,7 +40,7 @@
#include "openmm/System.h"
#include "openmm/LangevinIntegrator.h"
#include "openmm/NonbondedForce.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
platforms/reference/tests/TestReferenceGBVIForce.cpp
View file @
e3b25204
...
...
@@ -42,7 +42,7 @@
#include "openmm/System.h"
#include "openmm/LangevinIntegrator.h"
#include "openmm/NonbondedForce.h"
#include "
../src/SimTKUtilities/
SimTKOpenMMRealType.h"
#include "SimTKOpenMMRealType.h"
#include "sfmt/SFMT.h"
#include <iostream>
#include <vector>
...
...
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