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Index
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All commands in alphabetic order
Add<Obj|All>
- Add objects to the soup
AddBond
- Add covalent bonds
AddCap<Obj|All>
- Add N/C-terminal capping groups
AddEnv<Atom|Res|Mol|Obj|All>
- Add to environment for surface calculations
AddHyd<Atom|Res|Mol|Obj|All>
- Add missing hydrogens
AddPos<Atom|Res|Mol>
- Sum atom positions to calculate average and standard deviation
AddRes
- Add terminal residue
AddSpring
- Link atoms with a spring
AddTer<Obj|All>
- Add C-terminal oxygens
AlignObj
- Align objects
Angle
- Set/get angle between atoms
AnimateImage
- Animate appearance and disappearance of images
AnimateWin
- Animate Windows
AnnealSteps
- Set simulated annealing steps
Antialias
- Switch antialiasing on/off
AtomPlasma
- Switch plasma inside atoms on/off
AtomSize
- Set size of atoms
AtomSymbol
- Switch element symbol inside atoms on/off
AtomTexture
- Set texture style of atoms
AutoMove<Obj|All>
- Move objects or scene automatically
AutoMoveImage
- Move images automatically
AutoMoveTo<Obj|All>
- Move objects or scene automatically to a certain location
AutoRotate<Obj|All>
- Rotate objects or scene automatically
AutoRotateTo<Obj|All>
- Rotate objects or scene automatically to a certain orientation
AveragePos<Atom|Res|Mol>
- Average atom positions
BFactor<Atom|Res|Mol|Obj|All>
- Set/get the B-factor
Ball<Atom|Res|Mol|Obj|All>
- Style atoms as balls
BallRadius
- Set ball radius in balls&sticks
BallStick<Atom|Res|Mol|Obj|All>
- Style atoms as balls&sticks
BindEnergyObj
- Calculate binding energies
Boundary
- Set cell boundary
BuildAtom
- Build single atom
BuildLoop
- Build central or terminal loop
BuildLoopDB
- Build loop data base
BuildMol
- Build peptide chain
BuildRes
- Build single residue
CD
- Change working directory
Cell
- Set/get simulation cell dimensions
Center<Atom|Res|Mol|Obj|All>
- Center atoms
Charge<Atom|Res|Mol|Obj|All>
- Set/get the summed up charge
Check<Atom|Res|Obj|All>
- Check structure quality
Clean<Obj|All>
- Clean objects for molecular dynamics simulation
Clear
- Clear scene
Color<Atom|Res|Mol|Obj|All>
- Set/get atom colors
ColorBG
- Color background
ColorBonds
- Color bonds
ColorFog
- Color fog
ColorHBo
- Color hydrogen bonds
ColorPar
- Set default color parameters
ColorSurf<Obj|All>
- Color surface
Compare<Atom|Res>
- Compare selections
Console
- Switch console on/off
ConsolePar
- Set console parameters
CoordSys
- Set coordinate system
CorrectCis
- Correct cis-peptide bonds during simulation
CorrectConv
- Correct naming conventions during simulation
CorrectIso
- Correct wrong isomeres during simulation
Count<Atom|Res|Mol|Obj>
- Count selected units
Crystallize<Obj|All>
- Crystallize objects to fill the unit cell
Cutoff
- Set force cutoff distance
Del<Atom|Res|Mol|Obj|All>
- Delete atoms
DelBond
- Delete covalent bonds
DelFile
- Delete file on disk
DelHyd<Obj|All>
- Delete all hydrogens
DelImage
- Delete images
DelRest<Obj|All>
- Delete restraints
DelTab
- Delete tables
DelWater<Obj|All>
- Delete all water molecules
Dihedral
- Set/get dihedral angle between atoms
Dipole<Atom|Res|Mol|Obj>
- Calculate electric dipole moments
Distance
- Set/get distance between atoms
Duplicate<Obj|All>
- Duplicate objects
Energy<Atom|Res|Mol|Obj|All>
- Calculate force field energies
EnergyUnit
- Set energy unit
Exit
- Exit YASARA
Experiment
- Choose and control experiments
FileSize
- Get file size
FillCellObj
- Fill simulation cell with object
FillCellWater
- Fill simulation cell with water
FirstSurf<Atom|Res>
- Get first surface atom(s) or residue(s) and area(s)
Fix<Atom|Res|Mol|Obj|All>
- Fix atoms during simulation
FlipTab
- Flip table axes
Fog
- Set fog density
Font
- Set font for 3D letters
FontFog
- Switch font fog on/off
Force<Atom|Res|Mol|Obj|All>
- Set/get force on atoms
ForceField
- Set force field
FormEnergy<Atom|Res|Mol|Obj|All>
- Calculate formation energies
FormatRes
- Format residue output
FramesPerSec
- Set screen update frequency
Free<Atom|Res|Mol|Obj|All>
- Free atoms during simulation
FullScreen
- Switch fullscreen mode on/off
Go
- Go to another position in the macro
Grab<Obj|All>
- Grab object or scene for mouse movement
GrabNext
- Grab next object for mouse movement
GrabPrev
- Grab previous object for mouse movement
GroupAngle
- Get angle between two atom groups
GroupDihedral
- Get dihedral angle between two atom groups
GroupDistance
- Get distance between two atom groups
HUD
- Switch head up display
Hide<Atom|Res|Mol|Obj|All>
- Hide atoms
HideArrow<Atom|Res|Mol|Obj|All>
- Hide arrows
HideHBo<Atom|Res|Mol|Obj|All>
- Hide hydrogen bonds
HideImage
- Hide images
HideMessage
- Hide text message at the bottom
HideRest<Atom|Res|Mol|Obj|All>
- Hide restraints
HideSecStr<Res|Mol|Obj|All>
- Hide secondary structure
HideSurf<Atom|Res|Mol|Obj|All>
- Hide surface
HideTrace
- Hide trace through atoms
ImageFog
- Switch image fog on/off
Install
- Install accessory program
Interactions
- Set force field terms
Join<Atom|Res|Mol>
- Delete split points
JoinObj
- Join objects to one final object
KekulizeBond
- Remove fractional bond orders
Label<Atom|Res|Seg|Mol|Obj|All>
- Add labels
LabelDis
- Label atom distances
LabelPar
- Set label parameters
LightSource
- Configure the light source
Link<Atom|Res|Mol|Obj|All>
- Find bonds automatically
List<Atom|Res|Mol|Obj>
- List selection
ListCon<Atom|Res|Mol|Obj>
- List contacts
ListFloat<Obj|All>
- List floating assignments
ListHBo<Atom|Res|Mol|Obj>
- List hydrogen bonds
ListRest<Atom|Res|Mol|Obj|All>
- List restraints and energies
Load*
- Import file with OpenBabel
LoadBMP
- Load image from BMP file
LoadPDB
- Load Protein Data Bank file
LoadPNG
- Load image from PNG file
LoadSce
- Load complete scene
LoadSim
- Load simulation snapshot in sim format
LoadTab
- Load formatted table
LoadTbl
- Load XPLOR distance and dihedral angle restraints
LoadXTC<Obj|All>
- Load simulation snapshot in XTC format
LoadYOb
- Load YASARA object
LogAs
- Log output of next command
Longrange
- Set long range interactions
MacroTarget
- Set macro target
MakeImageObj
- Make object with attached image
MakeTab
- Make a table
MakeTextObj
- Make text object to print 3D letters
MarkAtom
- Mark atom with fireflies
Mass<Atom|Res|Mol|Obj|All>
- Calculate mass
Menu
- Switch menu on/off
MinStep
- Set energy minimization step
MouseWheel
- Assign command to mouse wheel
Move<Atom|Res|Mol|Obj|All>
- Move atoms, objects or scene
MoveMesh
- Move polygon mesh
Name<Atom|Res|Seg|Mol|Obj>
- Set/get names of objects, segments, molecules, residues and atoms
NiceOri<Obj|All>
- Orient objects nicely
Occup<Atom|Res|Mol|Obj|All>
- Set/get the occupancy
Oligomerize<Obj|All>
- Oligomerize objects to generate the biologically active form
OnError
- Set error action
OptHyd<Obj|All>
- Optimize hydrogen bonding network
Optimize<Res|Mol|Obj|All>
- Optimize molecular geometry
Ori<Obj|All>
- Set/get object or scene orientation
P5
- Set state of p5 data glove
PWD
- Print working directory
PlayMacro
- Play back macro
PlayMovie
- Play back macro as a movie
PointPar
- Set point and line radius and plasticity in wire frames
PointerStyle
- Set style of mouse pointer
Pos<Atom|Res|Mol>
- Set/get atom positions
Pos<Obj|All>
- Set/get object or scene position
PosText
- Position and justify text
PressureCtrl
- Set pressure control
Print
- Print text
PrintCon
- Print to console
PrintHUD
- Print to head up display
PrintObj
- Print to text object
Processors
- Set/get number of processors to use
Projection
- Set perspective or parallel projection
Prop<Atom|Res|Mol|Obj|All>
- Set/get the property value
QuantumMechanics
- Set quantum mechanics method
RMSD<Atom|Res|Mol|Obj>
- Calculate RMSDs
RMSF<Atom|Res|Mol>
- Calculate root mean square fluctuations
Radius<Atom|Res|Mol|Obj|All>
- Calculate the VdW radius
RaiseError
- Display error message
RayTrace
- Create raytraced screenshot using POVRay
RecordLog
- Record all console output in a log file
RecordMacro
- Record all following commands in a macro
Redo
- Redo changes
Regularize<Obj|All>
- Regularize covalent geometry
Remove<Obj|All>
- Remove objects from the soup
RemoveEnv<Atom|Res|Mol|Obj|All>
- Remove from environment for surface calculations
Renumber<Obj|All>
- Renumber objects
RenumberRes
- Renumber residues
RequireVersion
- Require a minimum YASARA version
Reset
- Reset YASARA to startup state
ResonateBond
- Introduce fractional bond orders
RestEnergy<Obj|All>
- Calculate restraint energies
RestViol<Obj|All>
- Get restraint violation statistics
RestrainDih
- Restrain dihedral angle
RestrainDis
- Restrain distance
RestrainPar
- Set/get restraining parameters
RestrainPot
- Set/get restraining potential function
Rotate<Obj|All>
- Rotate objects or scene
RunPlugin
- Run Python plugin
SampleDih
- Sample dihedral angles
SampleLoop
- Sample central or terminal loop
Save*
- Export file with OpenBabel
SaveBMP
- Save screenshot as Windows bitmap
SaveMPG
- Save MPEG video
SaveMacro
- Save a macro to restore the current state
SavePDB
- Save Protein Data Bank file
SavePLI<Atom|Res|Mol|Obj>
- Save plugin input file
SavePOV
- Save POVRay scene description
SaveSce
- Save complete scene
SaveSim
- Save simulation snapshots in sim format
SaveTab
- Save formatted table
SaveTbl
- Save XPLOR distance and dihedral angle restraints
SaveXTC
- Save simulation snapshots in XTC format
SaveYOb
- Save YASARA object
ScaleForce
- Set/get force scaling factors
ScaleRest<Atom|Res|Mol|Obj|All>
- Scale restraints
Screen
- Fix YASARA window on a certain screen
ScreenSize
- Set/get window and fullscreen size
SearchDoc
- Search documentation
SecStr<Res|Mol|Obj|All>
- Set/get secondary structure
SecStrPar
- Set secondary structure display parameters
SelectTab
- Select table to add cells
SeqSelector
- Switch sequence selector on/off
Shell
- Execute shell command
Show<Atom|Res|Mol|Obj|All>
- Show atoms
ShowArrow
- Show arrows between atoms or points
ShowBox
- Show a rectangular box
ShowButton
- Show clickable button
ShowCom
- Show command description
ShowCone
- Show a cone, cylinder, pyramid or prism
ShowDoc
- Show documentation
ShowESP
- Show electrostatic potential
ShowHBo<Atom|Res|Mol|Obj|All>
- Show hydrogen bonds
ShowImage
- Show images
ShowMessage
- Show text message at the bottom
ShowRest<Atom|Res|Mol|Obj|All>
- Show restraints
ShowRota<Res|Mol|Obj|All>
- Show side-chain rotamers
ShowSecStr<Res|Mol|Obj|All>
- Show secondary structure
ShowSimGrid
- Show simulation grid
ShowSphere
- Show a sphere or ellipsoid
ShowSurf<Atom|Res|Mol|Obj|All>
- Show surface
ShowTab
- Show table data as 3D object
ShowTorus
- Show a torus
ShowTrace
- Show trace through atoms
Sim
- Control simulation
SimSpeed
- Set simulation speed
SimSteps
- Set number of simulation steps per screen update
SolvDensity
- Get solvent density in simulation cell
SolvEnergy
- Calculate solvation energy
SpaceballButton
- Assign command to Spaceball button
SpaceballPar
- Set Spaceball parameters
Span<Atom|Res|Obj>
- Determine first and last unit spanning a selection
SpeedUp
- Speed up movements when graphics are slow
Split<Obj|All>
- Split objects at split points
Split<Atom|Res|Mol>
- Introduce split points
Stereo
- Set stereo mode
StereoPar
- Set stereo parameters
Stick<Atom|Res|Mol|Obj|All>
- Style atoms as sticks
StickRadius
- Set stick radius
StopLog
- Stop log recorder
StopMacro
- Stop macro playback or recording
StopPlugin
- Stop running plugin
Style
- Set general display style
StyleWin
- Style Windows
Sup<Atom|Res|Mol|Obj>
- Superpose objects
Surf<Atom|Res|Mol|Obj|All>
- Calculate surface areas
SurfPar
- Set/get surface parameters
SwapAtom
- Swap chemical element of atoms
SwapBond
- Swap order of covalent bonds
SwapHyd<Obj|All>
- Swap hydrogen ordering in residues
SwapImage
- Swap images
SwapObj
- Swap two objects in the list
SwapPosAtom
- Swap atom positions
SwapRes
- Swap residue side-chains
Switch<Obj|All>
- Switch objects on/off
Tab
- Set/get table cells
Tabulate
- Add cells to table
Temp
- Set/get simulation temperature
TempCtrl
- Set temperature control
Time
- Set/get simulation time
TimeStep
- Set simulation time step
Transfer<Obj|All>
- Transfer objects into another coordinate system
Transform<Obj|All>
- Transform objects
TypeAtom
- Get the atom type
TypeBond
- Assign bond orders automatically
Undo
- Undo changes
UndoLevels
- Set number of undo levels
Unlabel<Atom|Res|Seg|Mol|Obj|All>
- Delete labels
UnlabelDis
- Delete distances labels
UnrestImage
- Let animated image disappear
UserInput
- Set user input
Volume<Atom|Res|Mol|Obj|All>
- Calculate volumes
Wait
- Wait for certain time period or condition
WarnIsError
- Treat warnings as errors
WinFont
- Set window font
WinTexture
- Set window background texture
Zoom<Atom|Res|Mol|Obj|All>
- Zoom in on atoms
pH
- Set/get default pH
pKaRes
- Set/get residue pKa