agilent software and informatics division software and informatics help laboratory managers /...
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Agilent’s Kalabie Electronic Lab Notebook (ELN)
Product Overview
Agilent Software and Informatics Division
LSCA Portfolio
Materials Sciences
Petrochemical/ChemicalEnvironmental TestingFood TestingForensics
Pharma/BiotechResearch and Disease DiscoveryDiscovery/DevelopmentQA/QC
Academia/GovernmentDiagnostics
Surface ScienceMaterials CharacterizationParticle Sizing
Life SciencesChemical Analysis
Software and InformaticsWorkstations Networked Data Systems Enterprise Solutions
Agilent Software and Informatics
Help laboratory managers / directors reduce the time, effort & cost to go from raw data to final insight
Help laboratory managers / directors reduce the time, Help laboratory managers / directors reduce the time, effort & cost to go from raw data to final insighteffort & cost to go from raw data to final insight
Chromatography / Instrumentation /
Spectrometry
• ChemStation• EZChrom Elite• OpenLAB ICM• MassHunter
Bioinformatics
• GeneSpring• Pathway Architect
LIMS
Preferred Providers• LabVantage• StarLIMS• Labtronics
Kalabie ELN
Enterprise Content
Management
• OpenLAB ECM• EMC2
Professional Services
Col
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Inform
Vision: The ELN is a focal point
Che
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Bio
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Ana
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ResearchProcesses
Research Activities
ELN
ResearchManagement
Support - Share
Agilent’s Kalabie Electronic Lab Notebook (ELN)
The 3 main problems Kalabie ELN is adressing
• How to improve R&D productivity ? Cost of R&D are surging but throughput remains flat– How to improve individual productivity ?– How to enhance internal knowledge sharing and collaboration ?– How to streamline overall research processes?
• How to secure Intellectual Property and cut some associated costs?– How to protect valuable IP information ?– How to ease information gathering for patent creation ?– How to enhance overall quality of experiment documentation ?
• How to reach IT efficiency:high reliability with low cost of operation ?– R&D systems are mission critical : how to maximize uptime?– How to rationalize systems management by avoiding desktop variability ?– What global partner can stand by me to support my business ?
What is Kalabie ELN ?
Kalabie provides a robust platform that can be used to …
– Document and manage experiments and insights
– Protect Intellectual Property– Facilitate collaboration by implementing
transversal processes between users– Support and bridge multiple R&D
disciplines through adapted Activity Profiles
– Connect to the R&D IS system– Accommodate for special requirements by
extensibility at various levels
An ELN with the User in Mind
Kalabie has been designed to be the R&D scientist everyday workspace• Day start / Day close permanent environment for experiments• Give access to all IS needed resources through integration
Kalabie provides a scientist dedicated working environment by specialty (role/area-specific)• Activity Profiles allows the definition of specific workflows for each specialty• Increase scientist individual productivity without overloading the workspace
with unnecessary functions
Activity ProfilesStandard Multidiscipline ordomain-specific as well ascustom
Application domains: Breadth and DepthBy managing Activity Profiles, Kalabie is usable across domains while preserving value by providing specific workflows
Core Components
Business Components
A single tool across all domains of the R&D organization
Kalabie Configurations
Communication Components
Multidiscipline Specific/Custom Standard Chemistry
Product Features
• User-centric feature set
– Simple and straightforward UI (focus on R&D not software training !)– Multidiscipline, Chemistry or custom environment: adapted to you discipline
• Knowledge Sharing & Mining
– Share, Find, Reuse and Report
• Integration to the Lab Informatics System
– The all day every day window to your Lab informatics– A true, highly scalable, enterprise solution with rapid deployment
• IP Protection and compliance
– Includes mechanisms for IP protection– 21 CFR part 11 compliant
Kalabie multidiscipline environment
• Meta data entry to facilitate information classification and searching– System provided information (Author, Notebook reference, Date…)– User selected information from Admin references (Project, sub-project…)
• Rich Flexible entry/attachment of text, images, objects– Insert and attach using Rich text Palette, Drag and drop and right click– Sophisticated version management of attachments– File size and types permitted are managed in Kalabie Admin– Attached files are opened using the software choice of the user (application on client station)
• Protocol Library– Content managed through the Kalabie Administration module is available to all authorized users– Cascading lists to fill protocol section with the appropriate library protocol content– Possibility to append several entries from the library within the same protocol section in an experiment.
Kalabie for Chemical Synthesis
• Follows chemist’s workflow (from design to results handling)• Contains contextual information (Project, Study, Lit. references …)• Advanced reaction design
– Multi-role molecule entry (reactant, intermediate, product, impurity, solvent, reagent and catalyst)– Accepts copy/paste of a reaction from Drawing Tool– Connects on local or global repositories for molecule searches– Allows structure validation (when connected to Checker)– Computes atom-atom mapping (uses cartridge functions)
• Complete set of calculation functions– Composition, expected results and results tables allow chemists to manipulate and convert quantities
needed within their experiments• Structured but flexible interface
– User interface is a mix of predefined, structured fields and rich text fields (like the protocol where lot of illustrations and attachments can be inserted)
• Accurate batch management– Mixture definition (multi compounds and multi additives) and reuse in subsequent experiments– Ability to fill analytical properties form and to record analysis performed
Knowledge Repository Mining
• Various search modes
– Keywords– Full text– Structure-driven– Fields– Advanced modes
• Personal files
• Permanent requests
• Exports
– Excel, RDF, SDF
Reporting• The experiment PDF (IP document) is available for each Activity
Profile• Simple data export from Kalabie Explorer to Excel is always
available• Export to Word• Standard 3rd party report tool against DB
Integration with the Lab Informatics System
• Kalabie has been designed to integrate specialized modules in a seamless way
• Kalabie is a 3-tier architecture which allows integration to be done a each level
– At the client level allowing the integration with desktop software e.g. Molecular Drawing tools
– At the middle tier (the Application Server) e.g. access to information sources, ADMS
– At the database level for data management e.g archiving systems.• Examples of integration realized
– Accelrys (Accord tools, Pipeline Pilot), MDL (Isis Draw, Isis Direct), Chemaxon(JChem), NuGenesis, Inventories (CAP, ACD), Registration, Naming Tools (ACD)
• OpenLab ECM
IP Protection
• IP Protection is based on key internal mechanisms– Electronic Signature– Long term data format preservation by relying only on XML and PDF
core formats– Administration options allowing the user to manage the type of data that
may be incorporated into the ELN– Search capabilities to find out anteriority information– 21 CFR part 11 conformity and particularly the audit trail mechanism
IP Protection: Document Generation
• WYSIWYS: what you see is what you sign
• Includes all experiment elements
• Use PDF as the standard format
IP Protection: Signature Workflow
• Signature workflow offers:• Graphical status• Notification of next
signers• Configuration:
• Witness rules• # level of validation
Users Benefits
• User Centric Work environment– Kalabie provides users with an interface that follows naturally the way they work
(process oriented)– Other vendors are document oriented
• Multi disciplined – Kalabie is truly designed to handle multiple disciplines (chemistry, biology, analytics…)
and will store all experiment types on the same knowledge base– Others were originally designed for one discipline
• Successful projects – 100% Kalabie projects successfully deployed in production as of today– All Kalabie implementation are connected to the existing IS– Complexity has always been mastered to simplify users daily processes
Architecture & Company Excellence
• Open and Scalable Integrated Enterprise Solution
– Our customers have been using Kalabie in full production for over 4 years, over multiple sites and hundreds of end users. The solution has been tested in real conditions for speed and efficiency (ex Sanofi Aventis)
– Kalabie is designed to integrate the customer R&D IS (ex. MerckSerono, Sanofi-Aventis, Solvay…)
– Kalabie will interface with the tools and applications that the customer uses already.
– Others oblige customers to take their whole suite
• The OpenLAB portfolio & The Agilent Brand premium
– The portfolio approach means that, not only will Kalabie integrate perfectly with ECM, but also that Agilent recognizes the need for integrating solutions from other vendors
– Long term guarantee is key for a system that is expected to handle the customer’s Intellectual Property over many decades
– Agilent offers guarantees that are difficult to match by smaller players
Kalabie Reference Examples
Merck Serono: the new division for innovative small molecules and biopharmaceuticals of Merck.
• In production since 2002.• Users in three countries (Geneva, Boston, Rome) on two continents.• A single system to cover all discovery chemistry activities (standard synthesis,
parallel synthesis, analytical experiments).• Integration with MDL, Accelrys technologies.• Migration of legacy notebook system (MDL technology) into Kalabie ELN.• Significant gains from tight integration with instrument data content management
system, Registration, Inventory and Patent filing systems.• Over 36,000 experiments recorded
Deployment Example
LocalInventory
Isis HostOracle
USA Europe
LocalInventory
Isis HostOracle
CompoundRegistration
RS3Oracle
ReactionsMolecules
AccordOracle
LAN
LAN
WAN
AnalyticalData
Management
ContentManagement
Data Access Layer
Accord S
DK
Com
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Nam
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KalabieServerELN
Database
Courtesy of Merck Serono
Kalabie
Kalabie Reference Examples
Solvay PharmaceuticalsAcquisition of Fournier by Solvay Pharmaceuticals to further expand its business
– 8000 FTE. R&D investment @ 15% of Sales.• Kalabie supports for 200 synthesis chemists (Trad Medchem, Parallel Synthesis,
Combichem)• Common application and knowledge base for 3 research centers
– Germany, Holland and France– Harmonization of practise across sites
• Support for existing IP process and its mid term evolutions• First common application between Solvay and Fournier Research organizations
Kalabie Reference Examples
Pierre Fabre Dermo Cosmetics : Guepard Project• Pierre Fabre selected Kalabie as the backbone of its information system
for 120 staff working in Dermo Cosmetics R&D. Completely deployed since Q1 2006.
• Pierre Fabre aim was to gain productivity, centralize knowledge and coordinate complex activities within projects across their different R&D activities.
• Using the standard Kalabie core functions, the working environment is adapted to different groups: formulation, non clinical security, toxicology, pilot, clinical security (in vitro, sensorial analysis, hypo-allergenicity, photo biology, bio metrology…)
• According to customer: « Guepard is a major step in setting up informaticstools to improve R&D overall efficiency»
Kalabie Reference Examples
Sanofi Aventis: one of the largest Pharma WW• Key selection factors were
– Usability as an all day/every day tool for chemists– flexibility, adaptability and scalabilty– Capacity for integration with existing IS
• Multi-site, multi-discipline, multi-lingual project deploying out to several hundred users on two continents (target 700+ users in 2007-2008)
Kalabie Reference Examples
• Industrial Affairs - Process Development: – Kalabie for Synthesis chemists deployed since End 2002
• Application used in native language: English, French, German and Hungarian• Over 20.000 experiments recorded• 4 sites operational with deployment to all sites going on
– Kalabie for Analysts V1 delivered => V2 to follow• Provide dedicated environment for the various Analytic practices (NMR, HPLC, Powder
Analysis, GC)
• Research (SMA) - Chemical Development:– Deployed on 3 sites, 3 languages. Other sites to follow– Configuration based on “Gap Analysis” workshop on existing Industrial Affairs
project.