- Page 1 and 2: VMD User’s GuideVersion 1.8.6Apri
- Page 3 and 4: 4.4.4 Molecule File Browser Form .
- Page 5 and 6: 8.3.20 molecule . . . . . . . . . .
- Page 7 and 8: List of Figures2.1 Sample VMD sessi
- Page 9 and 10: Chapter 1IntroductionVMD is a molec
- Page 11 and 12: 1.4 AcknowledgmentsThe authors woul
- Page 13 and 14: • TachyonThe Tachyon multiprocess
- Page 15 and 16: Figure 2.1: Sample VMD session disp
- Page 17 and 18: 2.5 An Introduction to Atom Selecti
- Page 19 and 20: selection: protein and (name CA or
- Page 21 and 22: no coordinate information. It must
- Page 23 and 24: Chapter 4User Interface ComponentsV
- Page 25 and 26: • Center (hot key ’c’)This mo
- Page 27 and 28: Hot Key Command Purposer, R mouse m
- Page 29 and 30: Hot Key Command Purpose+,f,F animat
- Page 31 and 32: information. Atoms shows the number
- Page 33 and 34: Animation SpeedThe rate of playback
- Page 35 and 36: can change the view of the scene, e
- Page 37: • Perspective - The view of the s
- Page 41 and 42: Hiding a rep. To hide a rep, double
- Page 43 and 44: Periodic TabThe Periodic tab contro
- Page 45 and 46: • Name - the name of the atom as
- Page 47 and 48: Figure 4.10: The Material Formslide
- Page 49 and 50: force-feedback (haptic) devices suc
- Page 51 and 52: the simulated spring is connected t
- Page 53 and 54: Figure 4.13: The Sequence formmolec
- Page 55 and 56: • Selections by chain: When there
- Page 57 and 58: Chapter 5Molecular Drawing MethodsE
- Page 59 and 60: When three or more bonds join at on
- Page 61 and 62: segment pieces are colored accordin
- Page 63 and 64: • Representation Method - The sur
- Page 65 and 66: 5.1.19 BeadsA bounding sphere is dr
- Page 67 and 68: those names to color the atoms. Mol
- Page 69 and 70: Figure 5.1: RGB color scale: the th
- Page 71 and 72: esname ALA to CYS TYRselects atoms
- Page 73 and 74: esname ’A 1’More importantly, r
- Page 75 and 76: the numeric sense) or greater than
- Page 77 and 78: Keyword Arg Descriptionall bool eve
- Page 79 and 80: FunctionDescriptionsqr(x) square of
- Page 81 and 82: Chapter 6Viewing ModesThere are man
- Page 83 and 84: sci-fi and horror movie showings. T
- Page 85 and 86: Name Description Default Render Com
- Page 87 and 88: • Dotted spheres are not drawn wi
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Chapter 8Tcl Text InterfaceThe Tcl
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• speed n: Set animation speed to
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last frame. If the frame is a speci
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- BWG - Blue to white to green.- Bl
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• antialias < on | off >: Turn an
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• cylinder {x1 y1 z1} {x2 y2 z2}
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• kill: Disconnect from the simul
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- ambient- specular- diffuse- shini
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the area contributions are coming f
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8.3.19 molLoad, modify, or delete a
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• modselect rep number molecule n
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• index n: Returns the id of the
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8.3.26 rockRotate the current scene
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8.3.33 vmdinfo(Tcl) Returns informa
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• -minmax {{ x min y min z min }
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In the VMD script library at http:/
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Sourceraster3dmsmsfaqbiocoretachyon
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Table 8.4: Description of Tcl callb
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version (2.2). Thus if you have Pyt
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• align(ref=None, move=None, fram
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esid5.frame()50>>> resid5.frame(22)
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ef=AtomSel(’backbone’,frame=0)f
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functions (e.g., listall()) overlap
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• update ui():• update on():Upd
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9.5.7 labelPython operations availa
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• add volumetric(molid, name, ori
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• set colorupdate(molid, rep, ono
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9.6 High-level Python InterfaceVMD
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9.6.2 MoleculeRepThe MoleculeRep cl
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Chapter 10Vectors and MatricesTcl d
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• veccross v1 v2 - Returns the ve
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• transaxis amount [deg|rad|pi]
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-axiszamount [rad|deg|pi] - Adds a
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Chapter 11Molecular Analysis11.1 Us
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vmd> set sel [atomselect top "water
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The decimal in ”1.0” is importa
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# get the sidechain atoms (CB and o
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Applying this to the alanin.pdb coo
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have the same number of atoms, then
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set transformation_matrix [measure
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}display update offfor {set i 0} {$
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Chapter 12Customizing VMD SessionsT
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• -nt : Do not display the VMD ti
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• VMDIMMERSADESKFLIP : Enable a s
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axes location lowerleftstage locati
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Index.mailcap, 177.vmdrc, 26, 89, 1
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VMDHTMLVIEWER, 174VMDIMAGEVIEWER, 1
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move, 35atom, 35fragment, 35highlig
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short circuit logic, 72, 75sleepcom