Isentris 4.0 includes the capability of taking advantage of Pipeline Pilot based calculations and analytics protocols. Values calculated in Pipeline Pilot can be added dynamically to the record set and used in Isentris Client tables, forms and graphs. The Isentris Client user can also request that an analytics Pipeline Protocol to be run using the current record set and generating a report that will be displayed on the client computer. This session will show a few examples of this integration and sketch out the deployment strategy for such solutions.

1. (ATS4-APP06) Isentris integration with
the Accelrys Enterprise Platform
Matthew Sage, PhD
Advisory Field Applications Scientist, Pre-Sales
matthew.sage@accelrys.com

2. The information on the roadmap and future software development efforts are
intended to outline general product direction and should not be relied on in making
a purchasing decision.

3. Pipeline Pilot access from Isentris
– Pipeline Pilot provides additional functionality
• Structure Clustering (spatial and charted)
• Ring Assembly
• Math, Calculators, SAR tables etc
• Access to any PLP Protocol
• if PLP licensed can create own protocols
• Kinome viewer (custom Protocol example)

4. Agenda
• Implementation
• Calculators
• Analytics
• On the Accelrys Enterprise Platform side

5. Implementation
• Isentris Configuration : define Pipeline Pilot Server
• Issue the Packaging Tool command to activate the Isentris
package:
pkgutil -r accelrys/isentris

6. Accelrys Enterprise Platform
• Credentials
– Best used with domain
authentication
– Set privilege on folder

7. Calculators
• Call
– By icon (all), field mapping is
done as necessary
– By right-click on field, selection
based on type (single field
only)

8. Calculators
• Calculated fields
– Back into the Field
selector
• Single field
returned prefixed
by input field
• Multiple fields
returned in
hierarchy
– Automatically
added to a
dynamic Table

9. Calculators in the back-end
• Send record set, incrementally by client buffer size, or in
one shot (“Required Single Call”)
• Can be re-generated after search
– APPLY_CALCULATION_FOR_NEW_SEARCH
– Set to ALWAYS or PROMPT (default: NEVER)
• Can be re-generated after form change
– APPLY_CALCULATION_FOR_NEW_FORM
– Set to ALWAYS or PROMPT (default: NEVER)

10. Analytics
• Send all records in one batch
• Can be interrupted
• Field mapping (see calculators)
• Generated file opened through client mime type

11. Accelrys Enterprise Platform
• Parameters
• Components:
– Isentris Reader
– Isentris Writer

12. Demo

13. Summary
• Isentris 4.0 can fully leverage the Accelrys Enterprise Platform and
bring to your user community a full set of scientific calculations,
dashboards, analysis and reports.
• This is out-of-the-box and available now.
• More…
– Learn about new Isentris features in (ATS3-APP03) What's new in Isentris 4.0
– Learn how to leverage your existing IDS in (ATS4-DEV02) Accelrys Query
Service: Technology and Tools
– (ATS4-DEV03) Accelrys Query Service: Apps and Examples
– Preview Accelrys Insight (ATS4-APP07) Isentris’ IDS technology leveraged in
the AEP to provide Web Based Decision Support