Collective Variables: Difference between revisions
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* [[Nucleic Acids]] | * [[Nucleic Acids]] | ||
* [[Ring Puckering]] | * [[Ring Puckering]] | ||
* [[Macrocycle Threading]] | |||
===Supported Types=== | ===Supported Types=== | ||
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| [[CV:ODIS|ODIS]] | | [[CV:ODIS|ODIS]] | ||
| distance between plane and point | | distance between plane and point | ||
| | |||
| | |||
|- | |||
| [[CV:OPOS|OPOS]] | | [[CV:OPOS|OPOS]] | ||
| absolute position in the oriented coordinate system | | absolute position in the oriented coordinate system | ||
| [[CV:OPOS2|OPOS2]] | |||
| absolute position in the superimposed coordinate system | |||
|- | |- | ||
| [[CV:ORAD|ORAD]] | | [[CV:ORAD|ORAD]] | ||
| radial distance in the oriented coordinate system | | radial distance in the oriented coordinate system | ||
| [[CV:ORAD2|ORAD2]] | |||
| radial distance in the superimposed coordinate system | |||
|- | |||
| [[CV:POS|POS]] | | [[CV:POS|POS]] | ||
| absolute position | | absolute position | ||
| [[CV:RAD|RAD]] | | [[CV:RAD|RAD]] | ||
| radial distance | | radial distance | ||
|- | |- | ||
| colspan="4" style="text-align: center; background-color: #CCCCFF;" | '''Angle''' | | colspan="4" style="text-align: center; background-color: #CCCCFF;" | '''Angle''' | ||
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|- | |||
| colspan="4" style="text-align: center; background-color: #CCCCFF;" | '''Special''' | |||
|- | |||
| style="width: 5em;" | '''Type''' | |||
| '''Description''' | |||
| style="width: 5em;" | '''Type''' | |||
| '''Description''' | |||
|- | |||
| [[CV:WORMPOS|WORMPOS]] | |||
| parametrical position of an axle inside a macrocycle | |||
| [[CV:WORMANG|WORMANG]] | |||
| orientation of an axle inside a macrocycle | |||
|- | |||
|- | |- | ||
| colspan="4" style="text-align: center; background-color: #CCCCFF;" | '''Energy''' | | colspan="4" style="text-align: center; background-color: #CCCCFF;" | '''Energy''' |