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Administrator To use the Search Options: 1. Click the Search Options tab. The Search Options window appears. If you want to... require that any reaction center present in the query overlap with reaction centers in the target. This preference applies only to reaction searching, then click: Hit must overlap reaction center. allow hits to contain molecular fragments in addition to that which was hit by the query, Extra fragments may be present in hit. 2. Take the appropriate action: If you want to... require that the tetrahedral stereochemistry of the target structure match that of the query structure, require that the double bond stereochemistry of the target structure match that of the query structure, then click: Match tetrahedral stereo. Match double bond stereo. allow uncharged carbon atoms in the query to match charged carbon atoms in the target, NOTE: Charged atoms in the query must always match charged atoms in the target, regardless of this setting. allow uncharged atoms in the query to match charged atoms in the target, NOTE: Charged atoms in the query must always match charged atoms in the target, regardless of this setting. Match any charge on carbon. Match any charge on heteroatom. allow fragments in the query to overlap (share one or more atoms) in the target, Fragments may overlap. allow a query drawn as absolute (hash/wedge bonds) to hit a target stored as relative. Absolute center hits relative 380•ChemFinder/Office CambridgeSoft Refining Your Search
If you want to... match a relative relationship between tetrahedral stereocenters. then click: Relative tetrahedral stereo Changing Chem- Finder/Office Settings If you want to... show the Status bar, hide the Status bar, then, from the View menu, ... make sure the box next to the Status bar is checked. click Status bar. You can change ChemFinder/Office settings so that ChemFinder/Office appears the way you want. You can customize the way the ChemFinder/Office window appears with the items on the View menu. You can change some of the ChemFinder/Office display features with the Preferences window. Customizing the Chem- Finder/Office Window Use the View menu to change the appearance of the ChemFinder/Office window. show the Hit List, which shows all of the places that Chem- Finder/Office has found the structure you want to find, hide the Hit List, The status bar disappears. click Show List. NOTE: This option only appears when the list is hidden. click Hide List. ChemFinder To use the View menu: 1. In the Data Source - Find Chemical Structures window, click the View menu. The View menu appears. 2. Take the appropriate action: If you want to... show the Standard toolbar, then, from the View menu, ... make sure the box next to the Toolbar option is checked. customize features, including: Commands, Toolbars, Menu, and Keyboard options, NOTE: This option only appears when the list is showing. click Customize. The Customize window appears. NOTE: This is a standard Windows feature. For more information, see the MS Word online Help. ChemOffice 2005 /ChemFinder/Office ChemFinder/Office • 381 Changing ChemFinder/Office Settings
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ChemOffice.Com ® ChemOffice ® Che
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License Information ChemOffice, Che
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· Licensed users of ChemOffice Ent
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computer, except as provided below.
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Q: IS IT OK TO COPY MY COLLEAGUE’
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A Guide to CambridgeSoft Manuals An
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Chapter 31: Changes and Audit Trail
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Administrator Tutorial 7: Docking M
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Administrator Connection Table . .
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Administrator Specifying Properties
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Administrator Undoing Changes . . .
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Administrator Chapter 28: Introduci
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Administrator Atom Properties . . .
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Administrator Deleting a Field Type
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Administrator Example 2. . . . . .
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Administrator Reaction Center . . .
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Administrator In addition to browsi
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Administrator Microsoft®Windows®
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Administrator Truncated-Newton-Raph
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Administrator the activation each t
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Administrator The following table d
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Administrator • Stereo Pairs—A
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Administrator • Bond Angles—Dis
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Administrator The Building Toolbar
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Administrator The Calculation Toolb
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Administrator 1. Right-click in the
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Administrator • In the Model Sett
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Administrator modes and color setti
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Administrator 26 •Chem3D Basics C
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Administrator 2. Click the ChemDraw
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3. Move the pointer over the C-C bo
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Administrator Add serial numbers an
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Administrator 5. Press the Enter ke
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Administrator In the Measurements t
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A molecule of Epinephrine appears.
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Administrator Tutorial 7: Docking M
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Administrator To save the iteration
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The allyl radical, CH 2 =CHCH 2·,
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Administrator Determine the raw spi
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Administrator atoms are relatively
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Administrator The following table d
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Administrator When Correct Atom Typ
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Administrator To use the same text
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Administrator Example 2. Building a
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Administrator copied into blank tab
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Administrator 3. Type the atom type
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Administrator Clean Up Structure or
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Setting Serial Numbers this step, y
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Administrator Refining a Model Afte
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Administrator Selecting Multiple At
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Administrator New in Chem3D version
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Administrator Dragging moves atoms
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Administrator 3. Hold down the Shif
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To position a plane in your model p
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Administrator • Second Positioned
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Administrator When sizing by partia
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Administrator If you want to displa
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Administrator Chem3D provides two o
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Administrator To add to a group: 1.
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Molecular Design Limited MolFile (.
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Administrator 124•Printing and Ex
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Administrator • Semiempirical Ext
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Method Type Advantages Disadvantage
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Administrator • A single point ca
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Administrator • Molecular mechani
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Administrator constant), while θ 0
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Administrator The van der Waals int
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Administrator 6. The modified value
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Administrator A variety of other ba
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Administrator Molecular wave functi
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Administrator activation barriers.
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3. From the Calculations menu, poin
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Administrator Intermediate status m
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Administrator staggered form. The m
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Administrator During dragging, the
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Compute Properties The Compute Prop
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Administrator C(2)-C(3)-C(4) bond a
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Administrator The procedures assume
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Administrator improvements in each
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Administrator • Overall errors in
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Administrator The following table c
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Administrator TRIPLET QUARTET QUINT
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Administrator 4. Click Run. A new m
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Administrator Minimizing Energy Min
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Administrator criteria, to optimize
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Administrator 6. Hold down the S ke
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Administrator Dipole Moment The dip
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Administrator Molecular Surfaces Mo
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Administrator 3. Click in the model
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Keyword Description 7. On the Prope
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Administrator Hyperfine Coupling Co
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Administrator 194•MOPAC Computati
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Administrator If you want to … re
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Administrator In the Results In tex
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Administrator Repeating a Gaussian
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Administrator To specify the calcul
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Property Description Property Descr
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Property Description Error Message
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Administrator Property Electronic E
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Administrator • Server—limits t
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Administrator To perform property c
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Administrator • From the ChemOffi
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Administrator 220•Introduction Ca
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Administrator Screen Element Table
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Administrator • From the View men
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Administrator A form displays data
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Administrator The database opens, a
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9. Click the Form tab. There should
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to see some of the information avai
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Administrator The Table view appear
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Administrator To search over a list
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Administrator 250•ChemFinder Tuto
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The Open dialog box appears. To cho
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A data source tree appears, contain
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ChemFinder saves the form with a .c
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The framed data box is labeled. NOT
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Administrator To save a metafile fr
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Administrator • Rich Text—displ
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Administrator Adding a Data Box Men
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Administrator Customizing Numbers U
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Administrator When the selection to
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To line up objects on a form: Admin
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Administrator to those usernames. M
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Administrator • Take the appropri
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Administrator • In the new dialog
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Administrator 282•Relational Data
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Administrator The following table s
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Administrator Creating Tables There
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Administrator ChemFinder creates a
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Administrator atoms contained in th
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Administrator • If you are editin
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Administrator The record is permane
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Administrator The plot appears in a
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Administrator Context menu options
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Administrator In the bottom diagram
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Administrator 308•Visualizing Dat
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The general procedure for importing
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Administrator Using Log Files Durin
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Administrator Export to SDFile When
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Administrator benz OR *bromo* Benze
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Search Type Administrator Normal Se
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Administrator The hit list will inc
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Page 390 and 391: Administrator 6. Set other options
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Page 394 and 395: To activate CombiChem/Excel: The Co
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Page 402 and 403: An analysis of the reaction steps a
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Page 408 and 409: Administrator The Open Chemical Str
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Page 422 and 423: Administrator You can organize coll
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Administrator A new Ancillary Data
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Administrator Replacing a Spectrum
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Administrator you enter an invalid
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Administrator Type of Measurement m
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Administrator 4. The spreadsheet ap
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Administrator Clicking the Changes
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. Administrator The version of the
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Administrator In some configuration
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Administrator 452• Changes and Au
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Administrator 2. If no form appears
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Administrator The Collection Tree a
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Administrator Managing the Audit Se
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Administrator The field appears in
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Administrator In the form we are sh
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Administrator For example, if there
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Administrator 506• Managing Secti
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Administrator • Default Font - yo
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Administrator Example 1 In this exa
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Administrator Associating a list of
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Administrator • Username - An opt
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Administrator To add a property lis
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Administrator from the Property dro
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Administrator The Field Properties
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Administrator Another feature of ta
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Administrator reactants and product
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Administrator To access the Add-In
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Administrator In the query table fi
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Administrator 546• Managing Field
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Administrator Adding a Collection L
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Administrator A menu appears. 4. Se
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Administrator the Rename command in
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Administrator Creating a Search Typ
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Administrator Chemical Structure Se
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Administrator To add states to a co
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Administrator • Unlocked Contents
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Administrator If the user wants to
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Administrator To view the export te
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Administrator To edit this data, 1.
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Administrator Setting the Region fo
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Administrator 584• User Administr
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Administrator 2. If Inherits Securi
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Administrator The Security tab appe
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Administrator To disable inherited
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Administrator Desired Result Remove
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Administrator 596• Managing E-Not
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Administrator Section Listeners E-N
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Administrator 604 • CambridgeSoft
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Administrator Accessing the Online
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Administrator The CS ChemOffice SDK
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Administrator Troubleshooting This
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Administrator Defining Substructure
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Administrator If an atom can be ass
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Administrator Example 3 In Example
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Administrator 14 13 H 2.197 -0.8229
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Administrator Connection tables by
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Administrator 32 3 12 1 0 0 0 33 3
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Administrator 13 * 3D displacement
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Administrator The field value for C
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Administrator Line 4e: C 1.53597 1
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Administrator CONECT 4 2 9 10 11 CO
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Administrator COMPND ATOM HETATM CO
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Administrator HO HO HO N H H N N H
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Administrator 686• Structural Que
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Administrator You do not need to sp
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Administrator 706• CS Oracle Cart
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Administrator Combi experiments 367
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Administrator Dihedral type field 6
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Administrator Exporting (continued)
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Administrator Importing (continued)
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Administrator Managing (continued)
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Administrator Mol_ID field 287 Mola
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Administrator Property query and ta
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Administrator Redo command 269, 299
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Administrator Search Details prefer
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Administrator Sextic bending consta
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Administrator User interface 9 User
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Administrator xxxviii• CambridgeS
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CAMBRIDGESOFT ChemOffice Desktop to
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CS ChemOffice Software Suites ChemO
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DESKTOP CS E-Notebook Electronic Jo
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DESKTOP CS ChemDraw Chemical Struct
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DESKTOP CS Chem3D Molecular Modelin
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DESKTOP CS ChemFinder Searching and
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DESKTOP CS ChemInfo Reference and C
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ENTERPRISE ChemOffice WebServer Ent
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KNOWLEDGE E-Notebook Enterprise Des
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KNOWLEDGE Document Manager Desktop
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KNOWLEDGE 21CFR11 Compliance Electr
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RESEARCH & Registration System Chem
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RESEARCH & Inventory Manager Chemic
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RESEARCH & CombiChem Enterprise Des
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RESEARCH & BioAssay HTS Biological
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RESEARCH & BioSAR Browser Biologica
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CHEMICAL ChemACX Database Available
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CHEMICAL The Merck Index Chemistry
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CHEMICAL Chemical Databases Referen
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CONSULTING & Consulting & Services
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CS Software Problem Report For fast
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