Your guide to YASARA View
°
Essentials
-
What you really have to know
°
Selections
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Tell YASARA what you want
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Commands
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Tell YASARA what to do
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File
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Load and save the scene or parts of it
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Edit
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Change content and properties of the soup
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History
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Undo and redo changes
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Objects
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Center, transform, transfer, remove, add and delete
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Split points - Edit split points, split and join entire objects
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Bonds
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Add, type and delete bonds
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Building
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Build atoms to molecules, oligomers, crystals and loops
Swap
chemical elements
,
atom positions
,
residue side-chains
and
entire objects
. Create
individual atoms
, or
residues
,
build loops
(
including the loop database
) or
entire proteins
,
extending them at the C-terminus
,
possibly adding missing oxygens
and
protection caps
. To prepare a molecular dynamics simulation,
clean the structures
. When looking at oligomers,
duplicate objects
, use the BIOMT transformations in the PDB file to
create the biological oligomeric state
or
add the crystal symmetry related copies
.
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AddCap<Obj|All>
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Add N/C-terminal capping groups
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AddRes
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Add terminal residue
°
AddTer<Obj|All>
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Add C-terminal oxygens
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BuildAtom
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Build single atom
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BuildLoop
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Build central or terminal loop
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BuildLoopDB
-
Build loop data base
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BuildMol
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Build peptide chain
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BuildRes
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Build single residue
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Clean<Obj|All>
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Clean objects for molecular dynamics simulation
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Crystallize<Obj|All>
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Crystallize objects to fill the unit cell
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Duplicate<Obj|All>
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Duplicate objects
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Oligomerize<Obj|All>
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Oligomerize objects to generate the biologically active form
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SwapAtom
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Swap chemical element of atoms
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SwapObj
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Swap two objects in the list
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SwapPosAtom
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Swap atom positions
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SwapRes
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Swap residue side-chains
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Geometry
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Set or optimize distances, angles and dihedrals
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Sampling
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Search conformational space
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Surface environments - Define the context of surface analysis
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Hydrogens
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Add, swap and delete
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Water
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Delete all waters
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Names and numbers - Set or get properties of atoms to objects
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Simulation
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Simulate the soup
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Analyze
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Analyze the soup
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View
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Change the appearance of the soup
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Effects
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Change and animate the scene
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Options
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Other commands
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Window
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Change the display properties
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Help
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Access the documentation and solve problems
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Index
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All commands in alphabetic order
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Recipes
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Answer complex questions
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Macros
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Automate your work with Yanaconda
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Plugins
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Extend YASARA with your own functions
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Scripts
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Use YASARA as a Python module
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Troubleshooting
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Get things going