getting the most from marvinsketch webinar oct16
TRANSCRIPT
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Your Presenter: Christine Flemming
Your Host: Anne-Marie Roche
Welcome to our Reaxys webinar!
Getting the Most out of MarvinSketch
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Need to know
• Webinar control panel:‘chat’ for questions or ‘ask a question’minimize option for full screen view
• Q&A after presentation
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Structure Editors
MarvinSketch
Elemental
GGA Ketcher
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IP access Log in
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Copy Paste
Copy and Paste “1-methyltryptamine”
1-methyltryptamine
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Flip
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Shortcuts
Mouse wheel scrolls canvas vertically
F6 resizes the structure
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FuseSprout
Undo
Undo button
Attaching Templates
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Add a single bond and type cooh
Abbreviation Groups
Templates>Groups
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Bond Shortcuts
Type “1”, “2”, or “3” for single, double, or triple bonds
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Select a portion
Press the space bar once
Hit spacebar a third time
Hit spacebar a second time
Stretch the bond
Rotate the bond in 2D
Rotate the bond in 3D
How to Move or Rotate a portion of the structure
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Search for (E) And (Z) Stereochemistry
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Results
The search retrieves both E and Z
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Add (E) And (Z) Stereochemistry Bond
Right click
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Search Again
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Create a template
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Up and Down Bonds
The search retrieves only beta-D
The query shows beta-D
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Up and Down Bonds – Ignore Stereo
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Draw the (R) configuration
Right click
(R) configuration
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(R) and (S): ReactionsRitalin
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Inversion of configuration
Apply the “Inv” label, then search by
substructure.
4 reactions are retrieved.
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Retention of configuration
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Make or Break a Bond
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Audience Poll: Voted for “Position Variation Bond” and “Link Nodes”
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Link Nodes
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Thank You
For more information and questions please contact [email protected]
Our next Reaxys webinar is scheduled for Thursday, Oct. 18 and will be an Introduction to Reaxys
Please fill out the survey that appears on your screen after leaving the webinar.
Go to www.trainingdesk.elsevier.com/reaxys for all training related materials