ChemDraw v17.0 User Guide - Columbia University …
ChemDraw 17.0 User Guide
ChemDraw 17.0
Table of Contents
Recent Additions
vii
Chapter 1: Introduction
1
About this Guide
1
Chapter 2: Getting Started
4
About ChemDraw Tutorials
4
ChemDraw User Interface
4
Toolbars
5
Documents
6
Chapter 3: Page Layout
15
The Drawing Area
15
The Document Type
15
Printing
17
Saving Page Setup Settings
18
35mm Slide Boundary Guides
18
Viewing Drawings
19
Tables
21
Chapter 4: Preferences and Settings
25
Setting Preferences
25
Customizing Toolbars
29
Document and Object Settings
29
Customizing Hotkeys
39
Working with Color
42
Document Settings
45
Chapter 5: Shortcuts and Hotkeys
51
Atom Hotkeys
51
Bond Hotkeys
54
Generic Hotkeys (tool switching hotkeys)
55
? Copyright 1998-2017 PerkinElmer Informatics Inc., All rights reserved.
i
ChemDraw 17.0
Modified Hotkeys
57
Drawing Reactions Using Hotkeys
57
58
Shortcuts
58
Nicknames
62
Chapter 6: Basic Drawings
64
Bonds
64
Atoms
69
Captions
70
Drawing Rings
79
Chains
82
Objects
83
Clean Up Structure
100
Checking Structures
102
Chemical Warnings
102
Chapter 7: BioDraw (Professional Level only)
105
BioDraw Templates
105
Customizable Objects
108
Chapter 8: Drawing Biopolymers
114
Biopolymer Editor
115
Protecting Groups
116
Pasting Sequences
117
Expanding Sequences
119
Contracting Labels
119
Modifying Sequence Residues
120
Merging Sidechains with Residue
120
Hybrid Biopolymers
124
IUPAC Codes
124
? Copyright 1998-2017 PerkinElmer Informatics Inc., All rights reserved.
ii
ChemDraw 17.0
Disulfide Bridges
129
Lactam Bridges
130
Chapter 9: Drawing Monomer Sequences
131
Drawing Amino Acid Sequences
134
Drawing RNA Sequences
140
Replacing Monomers
142
Copying Sequence(s) as HELM String
143
Pasting HELM Strings
144
Monomer Editors
144
Chapter 10: Advanced Drawing Techniques
151
Coloring Objects
151
Labels
152
Attachment Points
155
Atom Numbering
157
Structure Perspective
159
Mass Fragmentation
159
Drawing Reactions
162
Stoichiometry Grid
168
Templates
171
Defining Nicknames
173
ChemScript
176
Chapter 11: Struct=Name (Professional Level)
178
Struct>Name
178
Name>Struct
182
Adding Structures to a Dictionary
184
Dictionary of FDA Approved Drugs
184
Chapter 12: Chemistry Features
185
Structure Analysis
185
? Copyright 1998-2017 PerkinElmer Informatics Inc., All rights reserved.
iii
ChemDraw 17.0
Stereochemistry
186
Chemical Properties
190
Chemical Annotations
197
3D Viewing
201
TLC
204
ChemNMR (Professional Level)
209
Chapter 13: ChemDraw/Excel and CombiChem
217
Setting Up ChemDraw/Excel
217
Importing tables
217
Importing hit lists
218
Exporting tables
218
Synchronizing Tables
219
Adding structures
220
Searching
221
R-Group analysis
222
Working with Structures
223
ChemDraw/Excel Functions
225
Chemical Properties
239
General Preferences
247
CombiChem
249
Chapter 14: ChemScript
257
Why use ChemScript?
257
How ChemScript works
258
Getting Started
258
Editing Scripts
259
Introducing the ChemScript API
260
Tutorials
261
Useful References
264
? Copyright 1998-2017 PerkinElmer Informatics Inc., All rights reserved.
iv
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