schmidt Analytical Workflow Manager pitcon - waters.com attributes (e.g. analytical instruments...
Transcript of schmidt Analytical Workflow Manager pitcon - waters.com attributes (e.g. analytical instruments...
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Waters® Analytical Workflow Manager Software -
Fully Integrating Analytical Services in your Business
Dr. Thomas Schmidt
Senior Product Manager
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©2006 Waters Corporation
Agenda
• Analytical Workflow using Waters® AWM
• AWM features
• AWM benefits
• Interoperability
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©2006 Waters Corporation
Workflow Management System?
“A system that completely defines, manages,
and executes “workflows“ through the execution
of software whose order of execution is driven by
a computer representation of the workflow logic.“
Workflow Management Coalition
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©2006 Waters Corporation
What is the AWM?
The Waters Analytical Workflow Manager is an integrated electronic solution combining workflow and information management with instrument control covering all steps of a typical workflow in the analytical service laboratory.
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©2006 Waters Corporation
Enterprise View
Analytical Service
Department
Analytical domainResearch domain
ResearcherRequest analytical services
Take over requested results
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©2006 Waters Corporation
Enterprise View
Analytical Service
Department
Analytical domainProduction domain
Quality assuranceRequest analytical services
Take over requested results
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©2006 Waters Corporation
Analytical Service Department
• Different labs with different analysis techniques
• Variety of instruments and software
• Different result formats
NMR MS IR/UV
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©2006 Waters Corporation
Analytical Workflow
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©2006 Waters Corporation
Analytical Workflow Manager
Request
Work list
Result data
Development Domain Analytical Domain
Results
Work list
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©2006 Waters Corporation
Single Point Of Access For All Labs
NMR Lab
IR/UV Lab
MS Lab
SampleTrack
OpenLynx™
IR Opus
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©2006 Waters Corporation
With the AWM, an analyst can...
• Manage analysis requests
• Convert requests into instrument work lists
• Capture results automatically
• View instrument results across multiple laboratories and analysis techniques
• Communicate selected results and analyst conclusions to the requester
• Secure data in a local repository accessible to global repository or long term archive
• Easily supply internal cost calculations to accounting
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©2006 Waters Corporation
With the AWM, an analyst can...• Easily check status and process analysis requests
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©2006 Waters Corporation
With the AWM, an analyst can...
• Link an analysis request to creation of an instrument work list
Instrument work list defines the sample information and measurement attributes (e.g. analytical instruments methods, reports) used by the instrument software
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©2006 Waters Corporation
With the AWM, an analyst can...• Easily generate work lists and capture results from
many instruments through pre-configured agents
NMRBruker Sample TrackBruker XWINNMRVarian InovaVarian MercuryVarian VXR
IRNicolet Omnic
HPLC/MSEmpower™MassLynx™Xcalibur 1.1Thermo FinniganMSOpalMSMaldiHP ChemStationAnalyst Sciex HP365, HP400Analyst Sciex HP 400 QTrap
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©2006 Waters Corporation
With the AWM, an analyst can...
• View results or status on demand from anywhere regardless of laboratory or technique
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©2006 Waters Corporation
With the AWM, an analyst can...
• Seamlessly communicate selected results and conclusions to the requester
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©2006 Waters Corporation
With the AWM, an analyst can...
• Seamlessly communicate selected results and conclusions to the requester
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©2006 Waters Corporation
With the AWM, an analyst can...• Easily supply internal costs to accounting
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©2006 Waters Corporation
With the AWM, an analyst can...
• Secure the results and raw data in a local repository that is easily integrated a long-term archive
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©2006 Waters Corporation
AWM Benefits
• Distributes the work automatically among labs
• Set up measurements and create work lists fordifferent instrument types with one tool
• Tracks samples and results during the complete sample lifecycle
• Improves communication between analytical labs and their clients
• Enhances collaboration between analytical labs
• Reduces turnaround time for order analysis
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©2006 Waters Corporation
Unique Optional Structure-Centric Sample Handling
• Customer submits structure proposal
• AWM provides– Structure viewer– Structure editor– Interface to ISISDraw
• Each analyst can make a new structure proposal
• History of structure determination is accessible
• Elaborate structure/substructure search engine– Structure/Result correlation: Find all related analysis
results and compound information at a glance
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©2006 Waters Corporation
Structure Viewer
Version
Centesimal composition Formula Weight
Double-clickopens editor
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©2006 Waters Corporation
Intelligent Data Handling
All related data is stored together logically
Common analytical data format (JCAMP)
Sample centric storage ofChemical structureSample informationAnalytical dataSupplemental materialReportsLab decisions...
Trackable decisions
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©2006 Waters Corporation
Comprehensive Search and Retrieval
Search for metadata
Full text search
Search for chemical structures also stereospecific
Search for chemical substructures also stereospecific
Search for analytical data spectra
chromatograms
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©2006 Waters Corporation
Workflow Management System
External Databases
LIMS/ELN
Instruments
Expert systems
Long-term archive
Native Software
Cost accounting
AnalyticalWorkflowManager
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©2006 Waters Corporation
• More samples in less time!
• Configuration, not customization!
• Route the samples through the lab!
• Follow the rules, but remain flexible!
• Collaborate and Communicate!
Analytical Workflow Manager
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©2006 Waters Corporation