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openmm
Commits
55237c86
Commit
55237c86
authored
Mar 06, 2014
by
peastman
Browse files
Fixed some overly stringent tests
parent
73643858
Changes
1
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1 changed file
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3 additions
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3 deletions
+3
-3
platforms/reference/tests/TestReferenceCustomNonbondedForce.cpp
...rms/reference/tests/TestReferenceCustomNonbondedForce.cpp
+3
-3
No files found.
platforms/reference/tests/TestReferenceCustomNonbondedForce.cpp
View file @
55237c86
...
@@ -398,7 +398,7 @@ void testDiscrete1DFunction() {
...
@@ -398,7 +398,7 @@ void testDiscrete1DFunction() {
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
());
ASSERT_EQUAL
_TOL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
()
,
1e-6
);
}
}
}
}
...
@@ -431,7 +431,7 @@ void testDiscrete2DFunction() {
...
@@ -431,7 +431,7 @@ void testDiscrete2DFunction() {
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
());
ASSERT_EQUAL
_TOL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
()
,
1e-6
);
}
}
}
}
...
@@ -468,7 +468,7 @@ void testDiscrete3DFunction() {
...
@@ -468,7 +468,7 @@ void testDiscrete3DFunction() {
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
const
vector
<
Vec3
>&
forces
=
state
.
getForces
();
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
0
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL_VEC
(
Vec3
(
0
,
0
,
0
),
forces
[
1
],
1e-6
);
ASSERT_EQUAL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
());
ASSERT_EQUAL
_TOL
(
table
[
i
]
+
1.0
,
state
.
getPotentialEnergy
()
,
1e-6
);
}
}
}
}
...
...
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