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tsoc
openmm
Commits
881d5570
Commit
881d5570
authored
Jul 06, 2011
by
Mark Friedrichs
Browse files
Fixed documentation for GBVIForce
parent
4cd1446f
Changes
1
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openmmapi/include/openmm/GBVIForce.h
openmmapi/include/openmm/GBVIForce.h
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openmmapi/include/openmm/GBVIForce.h
View file @
881d5570
...
...
@@ -147,7 +147,7 @@ public:
* @param index index of the bond for which to set parameters
* @param particle1 index of first atom in bond
* @param particle2 index of second atom in bond
* @param bondLength bond length
* @param bondLength bond length
, measured in nm
*/
void
setBondParameters
(
int
index
,
int
particle1
,
int
particle2
,
double
bondLength
);
/**
...
...
@@ -204,11 +204,11 @@ public:
*/
void
setCutoffDistance
(
double
distance
);
/**
* Get Born radius scal
l
ing method
* Get Born radius scaling method
*/
GBVIForce
::
BornRadiusScalingMethod
getBornRadiusScalingMethod
(
void
)
const
;
/**
* Set Born radius scal
l
ing method
* Set Born radius scaling method
*/
void
setBornRadiusScalingMethod
(
BornRadiusScalingMethod
method
);
/**
...
...
@@ -220,11 +220,11 @@ public:
*/
void
setQuinticLowerLimitFactor
(
double
quinticLowerLimitFactor
);
/**
* Get the upper limit used in the quintic spline scaling method
(typically 0.5-0.8
)
* Get the upper limit used in the quintic spline scaling method
, measured in nm (~5.0
)
*/
double
getQuinticUpperBornRadiusLimit
(
void
)
const
;
/**
* Set the upper limit used in the quintic spline scaling method
(typically 0.008
)
* Set the upper limit used in the quintic spline scaling method
, measured in nm (~5.0
)
*/
void
setQuinticUpperBornRadiusLimit
(
double
quinticUpperBornRadiusLimit
);
protected:
...
...
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