During our demo, you’ll learn how our latest cloud-based and collaboration-friendly ELN, Signals™ Notebook, will give you everything you’ve loved about Elements— and more! More easily record your research data in notebooks and experiments, organize, share, find and filter data. Have more eureka moments with Signals Notebook. Site Subscription Site Subscriptions are a convenient, affordable way to access or distribute the application throughout your organization (Academic or Commercial).
Perkin Elmer Electronic Notebook
Version 3.1.7 [201806]
Export, Normalize and Exploit Reactions from ELNs
Method Validation Software
Synthetic chemistry is at the core of pharmaceutical drug discovery.Although small molecule informatics is well understood and supportedby multiple vendors, the field of reaction informatics is relativelyunder-developed. Unlike molecular modelers and computational chemists,real bench chemists have relatively few software tools to assist themin the process of making molecules (efficiently, the first time, andin sufficient yield). A better understanding of chemical reactionscan be used to improve the design-make-test cycle, both for in-housesynthesis and outsourcing to contract research organizations (CROs).
NextMove Software's HazELNut suite of tools is designed tohelp pharmaceutical companies unlock and exploit the wealth ofknowledge in their own in-house Electronic Lab Notebook (ELN) systems.The raison d'etre of most ELNs is to capture intellectual property,such as assisting in patent filings, with data analysis and exploitationoften overlooked or afterthought. As a result, these systems areoptimized from fail-safe transactions, audit logs and fine-grainsecurity, making even simple queries and analysis difficult, slowor impossible.
Whilst initially designed to assist in the export of reactiondatabases as reaction SMILES, MDL RXN or MDL RD files (containingexperimental data such as reactant volumes, temperature, productyields and experimental write-ups) from Perkin Elmer Informatics'(formerly CambridgeSoft's) e-Notebook ELN and BioVia's (formerlyAccelrys/Symyx) ELN systems, the HazELNutsuite has evolved to also encompass downstream reaction processingindependent of the data source; operations such as reaction normalization,duplicate checking/elimination, atom-mapping analysis, role assignment,2D co-ordinate generation, reaction similarity searching and so on.
Perkinelmer Eln
As of mid of 2015, HazELNut has sucessfully beenused at eight out of the top twelve pharmaceutical companies.