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tsoc
openmm
Commits
7a5c9736
Unverified
Commit
7a5c9736
authored
Oct 11, 2023
by
Matt Thompson
Committed by
GitHub
Oct 11, 2023
Browse files
Note that w_cross has units of inverse distance (#4263)
* Note that w_cross has units of inverse distance * Grammar
parent
e1257e5e
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openmmapi/include/openmm/VirtualSite.h
openmmapi/include/openmm/VirtualSite.h
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openmmapi/include/openmm/VirtualSite.h
View file @
7a5c9736
...
@@ -136,7 +136,8 @@ private:
...
@@ -136,7 +136,8 @@ private:
* r<sub>1</sub> + w<sub>12</sub>r<sub>12</sub> + w<sub>13</sub>r<sub>13</sub> + w<sub>cross</sub>(r<sub>12</sub> x r<sub>13</sub>)
* r<sub>1</sub> + w<sub>12</sub>r<sub>12</sub> + w<sub>13</sub>r<sub>13</sub> + w<sub>cross</sub>(r<sub>12</sub> x r<sub>13</sub>)
*
*
* The three weight factors are user-specified. This allows the virtual site location
* The three weight factors are user-specified. This allows the virtual site location
* to be out of the plane of the three particles.
* to be out of the plane of the three particles. Note that while w<sub>12</sub> and
* w<sub>13</sub> are unitless, w<sub>cross</sub> has units of inverse distance.
*/
*/
class
OPENMM_EXPORT
OutOfPlaneSite
:
public
VirtualSite
{
class
OPENMM_EXPORT
OutOfPlaneSite
:
public
VirtualSite
{
public:
public:
...
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