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Administrator Using Log Files During the import, ChemFinder creates a log file of the actions taken. The log file (.log) is a text file that is created alongside the input file and overwrites any previous log file. The log records data of your choice form the following options during the import. • Errors—errors and warnings • General data—information about the input file and import process • Records processed—logs an entry for each record of the input file • Structures registered—logs an entry for each structure stored in the database • Data registered—shows each data item stored in the database • Database schema—shows input fields found and columns generated The log file for an RDFile import additionally presents an overview of the data table hierarchy within the RDFile. You can choose whether to create the log file or not. If you choose to create the log file, you can save it with a different name or append to an existing log file. Importing from a Specified Location You can start an import from an arbitrary location in an SDFile or RDFile, such as a byte or line number. To set the location from which to import: 1. Click the Advanced tab of the Date Import dialog box. 2. Select the appropriate options. To start from the beginning of the SDFile or RDFile a specified line number a specified byte number 3. Click Import. Click • beginning. • line and type the line number. Reading a Structure • byte and type the byte number. a specified record • record and type the record number. In addition to importing, ChemFinder can read files of any of the supported structural formats. For example, if you have structures stored in 312•Importing and Exporting Data CambridgeSoft Importing Data
ChemDraw format, you can open them directly from ChemFinder without having to import or redraw them. To read a structure from a file into a structure box: 1. In the structure box, right-click and choose Read Structure. The Open dialog box appears. 2. Choose the file to read. 3. Click Open. The structure is read into the structure box. The database is not affected by this operation until you choose Commit Changes or move off of the record. Drag and Drop You can drag certain types of files from the Windows Explorer or Desktop onto ChemFinder. The following table summarizes the ChemFinder Drag and Drop options. type of file supporte d file types Structure • CDX • SKC • MOL • MST Graphic • WMF • EMF comments Must be dropped into a structure box. Must be dropped into a picture box. Form • CFW Does not need to be dropped onto an existing form. Multiple files can be dropped at once, but you cannot mix types (as defined in column 1 of the table). If several structure or graphic files are dropped at once, they are loaded into successive ChemFinder records. If only one is dropped, you are asked if you wish to append the structure/graphic in a new record or overwrite the existing record. If more than five structures/graphics are dropped, an alert will ask you if you wish to proceed. Dropping one or more form files opens the forms, without affecting the current form and database. Importing Text Files You can import comma or tab delimited text files. The Import Delimited Text command uses the same dialog and has most of the same features as Import SDFile. Delimited text (DT) differs from SD files in that: • DT files cannot contain structures. • DT files are not as well defined, and require interpretation in order to determine field names and delimiter type. To import text records into a new database: 4. Open a new, blank form. 5. On the File menu, point to File Import and choose Delimited Text. 6. In the File Open dialog, browse to select the input file. The input file is scanned to determine the field delimiter. If the file extension is “.csv,” the delimiter is taken to be comma. If the extension is “.txt,” the first few lines of the file are examined for the presence of commas or tabs. If one or the other is found, it is taken as the delimiter. If not, an alert is presented. This alert will appear in two cases: c. The input file contains only a single column. The alert can be ignored (click OK). ChemFinder ChemOffice 2005/ChemFinder Importing and Exporting Data • 313 Importing Data
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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 b. From the Structu
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Administrator In the Measurements t
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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 For example, consider
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Administrator • From the Computat
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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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ChemFinder saves the form with a .c
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Administrator To save a metafile fr
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Administrator • You can configure
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Administrator The Open Chemical Str
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Administrator 3. From the Molecules
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Administrator 388• Introducing E-
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Administrator You can organize coll
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Administrator Desired Result Change
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Administrator To export to MS Word:
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Administrator 410• E-Notebook Use
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Administrator NO 2 NO 2 Me Me HC(OE
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Administrator • Top of Arrow as R
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Administrator • Equivalents - the
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The example below shows the Prepara
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Administrator Ethanol was selected,
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Administrator Type in the AutoText
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Adding Properties to Property Lists
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Type of Measurement Permitted Units
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3. Enter the URL and click OK. Work
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Administrator A new Ancillary Data
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Administrator Replacing a Spectrum
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The row is removed from the Table.
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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 The Field Properties
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Administrator reactants and product
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Administrator Adding a Collection L
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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 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 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 COMPND ATOM HETATM CO
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Parameter Table Use Parameter Table
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Administrator Atom-to-Atom mapping
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Administrator Combi experiments 367
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Administrator Creating (continued)
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Administrator Dihedral type field 6
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Administrator Exporting (continued)
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Administrator Frame interval contro
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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 Opening (continued) p
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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 Subforms (continued)
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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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ENTERPRISE Oracle Cartridge Enterpr
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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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