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Accelrys Announces Experiment Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management Enterprise Lab Management Ted Pawela Sr. Director, Product Marketing [email protected]

Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

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Today’s complex lab environments inhibit innovation productivity, slowing time-to-market and increasing costs. Improve lab efficiency, knowledge capture and reuse with a solution that quickly transforms scientific data into knowledge. For Chemicals, Manufacturing and Materials companies.

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Page 1: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Accelrys Announces ExperimentAccelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab ManagementEnterprise Lab Management

Ted PawelaSr. Director, Product [email protected]

Page 2: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Agenda: The New Experiment Knowledge Base Solution

• Enterprise Laboratory Management:  Pillar of Accelrys’ Enterprise 

R&D Architecture

• Accelrys Experiment Knowledge Base (EKB):  A New Solution for 

Enterprise Laboratory Management

• The Problem:  Complex laboratory environment blocks innovation

• Solution Overview:  EKB transforms scientific data into knowledge

• The Benefits: Laboratory Efficiency Knowledge Capture & Reuse• The Benefits:  Laboratory Efficiency, Knowledge Capture & Reuse

• Target Markets/Customers:  Chemicals, Manufacturing, & Materials

• Conclusion

Page 3: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Enterprise Laboratory ManagementA Pillar  of the Accelrys Enterprise R&D Architecture

Enterprise Lab Management

Workflow Definitionand Capture

Modeling andSimulation

Data Managementand Informatics

3rd Party, Partner & ISV Apps

Discovery Studio

Materials Studio

Isentris Registration Pipeline PilotLEA ELN EKB

Scientific and Generic Services Data Management Services

Pipeline Pilot Enterprise Platform

BiologyBiologyNotebookNotebookLEALEAORACLEORACLE

ExperimentWorkflow

InstrumentInterfacesReportsWork

RequestExperimentWorkflow

InstrumentInterfacesReportsWork

Request

LIMSLIMS

BiologyBiologyVaultVaultLEALEAORACLEORACLE

SchedulingExperiment Design

Modeling

SchedulingExperiment Design

Virtual Chemistry

Data Mining & Analytics

OtherOtherRecipesRecipes

…Registration ImagingBiologyModeling

& Simulation

Page 4: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Delivering Core Services for Experimentation

• Manages standard lab operations

– Flow of materials, samples, & k h d lirequests & tasks, scheduling..

• Built on Pipeline Pilot

• Shared across applicationsShared across applications

– Provides both web user interface and thick‐client plug insplug‐ins 

• Scalable across the enterprise

– Within the lab, between departments & across business boundaries

• Delivered in ELM SolutionsDelivered in ELM Solutions

Page 5: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Applications Layer: Solutions built on ELM

• Persona‐based interfaces to accommodate all scientific personnel

– Electronic Laboratory Notebook

– Lab Execution & Analysis 

– Experiment Knowledge Base– Experiment Knowledge Base

– More…

• Thick & thin clients using same scientific services

• Compatibility with future laboratory informatics solutions

– All Accelrys products and services that integrate with the lab will be delivered in the Accelrys ELMin the Accelrys ELM

Page 6: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Announcing Experiment Knowledge Base (EKB) :Packaged Professional Services Solution for ELM

• Complex laboratory environment prevents effective use of data and information – creating inefficiency and blocking innovationinformation  creating inefficiency and blocking innovation

• EKB helps customers to intelligently plan, execute, analyze, and l d h d l f lmanage experiments related to the development of materials.

• EKB accelerates materials innovation by improving laboratoryEKB accelerates materials innovation by improving laboratory efficiency and unlocking the value from experimental data 

EKB i i h i i l b l i• EKB integrates with existing lab systems to protect legacy investments

Page 7: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Accelrys Experiment Knowledge Base:  Enabling  Laboratory Sustainability

• Packaged Professional Services Solution for Enterprise Laboratory

AnalyticalMethods

Experiment Planning &

Design

StepsManagement

• Based on Pipeline Pilot and ELM

• Adds important “Scientific

Steps

Work Request & Scheduling

Work Request & Scheduling

• Adds  important  ScientificServices” created by Accelrys Professional Services Materials &

SamplesEquipment

• Preconfigured user interface for materials application domains (catalysis, polymers, biology, etc.)

Laboratory Software

SDMS ReportingCDSLIMS Visualization

p

Instruments

GCMS LCMSNMRHPLC FT‐IR

EKB helps customers to intelligently plan, execute, analyze, and manage experiments related to the development of materials.

Page 8: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

The Problem:  Laboratory Complexity Slows Innovation

’ S f

LabsF l ti A l i l

Today’s Scientific Lab A Diverse Information Ecosystem

Formulation Process Analytical Contract

Groups / TeamsMethod dev. QA/QCMethod Val Lab  ManagerExecution QA/QCMethod  Val gExecution

Processes

Laboratory

FormulationSynthesis  ProcessBiology Analytical

Instruments

Laboratory Software

SDMS ReportingCDSLIMS Visualization

Instruments

GCMS LCMSNMRHPLC FT‐IR

Page 9: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

The Problem:  Scientific Data Silos Lock Out Knowledge

• Explosion of experimental data

• Limited or no re‐use of data

• No single source for search, analysis, or reporting

• No consistency in experiment planning & execution

• Existing systems don’t allow scientists to extract knowledge from data

Laboratory 

• What experiments have already been run?

• What experiments should be run next?

Instruments

aboratorySoftware

SDMS ReportingCDSLIMS Visualization

GCMS LCMSNMRHPLC FT IR

• Creating Big Business Pain:

• Experiments are repeated

• Time & money is lostGCMS LCMSNMRHPLC FT‐IR

y

• Environmental impact (energy, waste)

Page 10: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

EKB Manages the Experimentation Process

• Planning – Ad‐hoc or statistically designed experiments to ensure that the experiments can be correlated with other i il isimilar experiments

• Execution – tracks the step‐by‐step workflow of experiments, gathers data produced from instrument files, spreadsheets, databases to eliminate manual piecing together of data.

• Analysis algorithms for ad hoc analysis of experimental data• Analysis – algorithms for ad‐hoc analysis of experimental data

• Reporting – Configurable report templates with integrated p g g p p gcharting, scatter plots and interactive reporting options

Mi i d K l d G ti t id t ti ti l• Mining and Knowledge Generation – to provide statistical guidance on what experiments should be performed next.

Page 11: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Transforming Data Silos into Actionable Knowledge

Project Report Job Report

Experiment Report

Site Report Managemen

Standard Reports

Query Builder

Query Visualizer

Ad‐hoc Query & Reporting

• Imports/accesses scientific data from 

t Reportdisparate sources

• Organizes Existing D t

EKB Data Mart

EKB Data Mart

Data

• Enables Standard & Ad‐hoc Data Queries MartMartAd‐hoc Data Queries

• Enables Mining of Existing Data

Extract, Transform, Load (ETL)

Existing Data

• Automates Standard Data Operations (e.g. 

Laboratory Software

SDMS ReportingCDSLIMS Visualization

Reporting)Instruments

GCMS LCMSNMRHPLC FT‐IR

Page 12: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

To Inform & Guide Future Experimentation

• Guides experiment setup, both ad‐hoc & structured

ddd

Experiment Design & Execution

Query BuilderQuery Visualizer

Ad‐hoc Query & Reporting

P j t

Standard Reports

structured

• Ensures Consistent i i

Validate

Project Report Job 

Report

Experiment Report

Site Report

Management Report

Experiment Execution

• Enables laboratory EKB Data Mart

EKB Data Mart

operations and tracks experiment status

Extract, Transform, Load (ETL)

• Enables Design of Experiments

Laboratory Software

SDMS ReportingCDSLIMS Visualization

Instruments

GCMS LCMSNMRHPLC FT‐IR

Page 13: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Accelrys EKB Empowers Breakthrough Innovation

Enable scientists to invent step‐out products moreAccelerate step out products more 

quickly, improving time‐to‐market

The Innovation Cycle

Build a corporate knowledge base that can be searched and 

data mined streamlining 

More ValueFrom Data

supply chain, reformulations

Scientists can find and learnScientists can find and learn from past experiments 

instead of repeating them saving time and cost

Reduce costsless repetition

Page 14: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Benefitting Materials R&D

Chemicals CPG AgroChemicals

Petro Chemicals

Manufacturing

FormulationsMarket 

Formulations

Catalysis

Polymers

ry Vertical M

Segm

ents

Other

Functional Horizontal Market SegmentsIndu

str

For Economically and Environmentally Sustainable Laboratory Operations

Page 15: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

Summary

EKB enables customers to develop better materials more quickly with fewer resourcesfewer resources

ResearchResearch

Compliance

DevelopmentDevelopmentCompliance

+Lab Efficiency & Productivity

+I i i P d

ManufacturingManufacturingInnovation in Products

=

Sustainable ScienceSustainable Business 

Page 16: Accelrys Announces Experiment Knowledge Base (EKB) for Enterprise Lab Management

CONTACT INFORMATION: Ted PawelaTed Pawela

Sr. Director, Product Marketing

T d l @ [email protected]