New version of PerkinElmer desktop lab software delivers SciFinder integration and more

ChemDraw prAdept Scientific (Letchworth, Herts.) is pleased to announce that PerkinElmer (Waltham, Massachusetts) has released a new version of its industry-standard desktop applications for chemical structure drawing and analysis, 3D molecular modelling and visualisation, and database search and management. ChemBioDraw® version 14.0 delivers integration with the CAS SciFinder® database; increased compatibility with third-party applications; a gel electrophoresis plate tool; and more.

With new ChemBioDraw Ultra version 14.0 software, users can search the SciFinder database – the world’s largest collection of molecular substances, reactions and related content – from within the ChemDraw interface. Simply open or draw a structure or a partial or complete reaction, select the components, then click to see the results in SciFinder, immediately – there’s no time-consuming cutting and pasting to do. This convenient, easy-to-use feature brings built-in chemical intelligence to the user’s searches.

To help users interact with third-party applications, ChemBioDraw 14.0 has two new “copy to clipboard” commands, for molfile and CDXML. This allows users to exchange structural information with other applications that can use these file formats. All the components of the ChemBioDraw 14.0 can now generate v2000 and v3000 molfiles, so users can work with an even greater range of structural descriptors.

ChemBioDraw 14.0 includes a biopolymer toolbar with disulphide and lactam bridges, beta and D-amino acids, DNA, RNA, protecting groups and linkers. Users can paste peptide, DNA and RNA sequences and have them interpreted chemically with sequence wrapping and shaping.

A new gel electrophoresis plate tool which provides arbitrary rotation for lane labels, plus the ability to drag and position band labels, paste data from Excel and other sources, and copy and paste between lanes.

Calculators for pKa, LogP and LogS enable scientists to explore important bio-availability properties such as acid dissociation, distribution and aqueous solubility for putative compounds. (The pKa and LogS calculators are only available with the Windows version of ChemBioDraw 14.0.)

For those who don’t need biology tools, the ChemDraw® Pro 14 Suite offers state-of-the-art drawing tools, properties prediction and much more. Although it doesn’t support the one-click SciFinder search facility, it has extensive online database querying capabilities. It also includes the gel electrophoresis plate tool.

ChemDraw® Standard 14.0 includes all the tools needed to draw publication-ready chemical structures and reactions. Its many additional features include structure clean-up and the ability to expand and contract labels; and it integrates smoothly with Microsoft® Office®.

For those needing to explore the structure and properties of large chemical and biological models, ChemBio3D® Ultra 14.0 (which includes ChemDraw Pro 14.0) brings workstation-quality molecular graphics and rigorous computational methods to the desktop. It features a Structure Browser to view sets of small structures and their properties for analysis and comparison. This latest version allows users to set up AutoDock runs to dock flexible ligands into receptors of known 3D shape and compare the goodness of fit; and to set up CONFLEX® runs to quickly explore conformational space and identify minimum energy conformations for small and large molecules.

ChemBioDraw, ChemBio3D and ChemBioFinder™ – a chemically and biologically intelligent database manager and search engine – are all included in the top-of-the-range ChemBioOffice® Ultra 14.0, which provides biologists and chemists with a comprehensive, integrated, up-to-date suite of scientifically intelligent applications for increased personal productivity and enhanced decision-making.

Organisations with a current site licence to ChemBioOffice Ultra 14.0 will be entitled, at no extra charge, to use an enterprise-deployable version of the ChemDraw for iPad® mobile application (“CDSL”) that can be made available site- and campus-wide, to add the benefits of mobile access to key ChemDraw functionality for drawing and sharing structures and reactions.

ChemBioDraw, ChemDraw Pro, ChemDraw Standard and ChemBioOffice are available for both Windows and Mac platforms. ChemBio3D is a Windows application.

These new versions of PerkinElmer desktop chemistry and biology software are available from Adept Scientific in the UK, Ireland, Germany, Austria and the Nordic countries. Details and prices can be found at http://www.adeptscience.com/chembiodraw

About Adept Scientific

Adept Scientific is one of the world’s leading suppliers of software and hardware products, consultancy and training for research, engineering, scientific and technical applications on desktop computers. The company, founded in 1984, has offices in the UK, Germany, France and throughout the Nordic region, serving customers in 19 countries. Full details and contact information for all Adept Scientific international offices are available at www.adeptscience.com; or telephone +44 (0) 203 695 7810.

About PerkinElmer

PerkinElmer, Inc. is a global leader focused on improving the health and safety of people and the environment. The company reported revenue of approximately $2.1 billion in 2012, has about 7,500 employees serving customers in more than 150 countries, and is a component of the S&P 500 Index. Additional information is at www.perkinelmer.com.

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Scientific research catalyst: new ChemBioOffice 13

Scientists who want to keep competitive, increase their productivity and enhance decision making should take a look at PerkinElmer’s just-released new edition of their powerhouse informatics suite, ChemBioOffice 13.

The latest version offers powerful new toolbars, calculations and cloud-based collaboration tools for secure sharing of structures, reactions and drawings with other scientists around the world. Additional biology functionality allows for easier correlation between biological activity and chemical structures.

There are also enhancements to ChemBio3D enabling synthetic chemists and biologists to generate three-dimensional models to assess the shape and properties of compounds, polymers, proteins in a manner accessible to both chemists and biologists alike. Meanwhile, ChemBioFinder helps scientists organise their compounds effectively, search for them and transform data into graphs for structure-activity relationship analysis.

Download our ‘top ten new features in ChemBioOffice 13’ datasheet to learn more or visit our laboratory software webpages.

 

PerkinElmer releases newest version of flagship informatics product: ChemBioOffice® Ultra 13.0 Suite

PerkinElmer Inc (Waltham, Mass), a global leader focused on improving the health and safety of people and the environment, has introduced the newest version of ChemBioOffice® Informatics Suite. Available from Adept Scientific (Letchworth, Herts), ChemBioOffice version 13.0 increases the productivity of scientists with improvements to the industry leading ChemBioDraw® and ChemBio3D® modules while providing secure cloud storage for improved data sharing.

The ChemBioOffice suite helps chemists and biologists to efficiently track their work giving scientists more time to focus on their research, visualise and gain a deeper understanding of their results and correlate biological activity and other properties with chemical structures. The new informatics product provides individual scientists within an organisation the tools they need to create publication-ready drawings of compounds, reactions, materials and their properties for use in electronic laboratory notebooks (ELNs) and databases as well as for querying chemical databases.

“A pressing challenge for our customers is to continually introduce new product candidates into the research and development pipeline in order to maintain competitiveness and ensure ongoing revenues,” said Michael Stapleton, General Manager of PerkinElmer Informatics. “We are very excited to provide chemists and biologists with the new ChemBioOffice Suite, a premium tool developed to help scientists turn data into actionable information and make decisions with greater confidence, thereby accelerating their discovery process.”

The improved biopolymer toolbar of the ChemBioDraw program, the world’s leading scientific drawing program, enables fast and easy modifications to larger therapeutic agents and molecular structures such as amino acids, peptides, RNA, DNA and nucleotides. In addition, users can now copy and paste any sequence into the program to manipulate part of, or the entire section of, a sequence in the search for modifications to gain a deeper understanding of their results and correlate biological activity with chemical structures.

To assess the shape and properties of small molecules and biochemical compounds, the ChemBio3D program enables synthetic chemists and biologists to generate 3D models. The ChemBio3D program can evaluate data input and provide valuable information such as the degree of fit of compounds into a receptor. In addition, the program acts as a hub for other 3D modelling programs, providing easy and consistent access to other computational and molecular modelling programs.

The addition of a sharable cloud location to ChemBioOffice makes it easier for scientists to collaborate by securely sharing and importing ChemBioDraw and ChemBio3D structures, reactions and drawings with other scientists around the world.

ChemBioOffice 13.0 is available now from Adept Scientific.

 

With offices in the UK, Germany and throughout the Nordic region, Adept Scientific is one of the world’s leading suppliers of software and hardware products for research, scientific, engineering and technical applications on desktop computers. Full details and contact information for all Adept Scientific international offices are available at www.adeptscience.com; or telephone +44 (0) 203 695 7810.

Introducing the ultimate software suite for Life Sciences: ChemBioOffice 2008

Adept Scientific (Letchworth, Herts) is pleased to announce the immediate availability of ChemBioOffice 2008 from CambridgeSoft Corporation’s full suite of integrated scientific desktop applications. ChemBioOffice is designed to aid individual chemists and biologists at their desktops and provide a shared solution to benefit scientists within an institution.

“The ChemBioOffice desktop suite is designed to enhance the overall effectiveness of the institution by lowering costs and improving innovative participation in, and achievement of, shared goals across the organisation”, said Michael G. Tomasic, Chairman and CEO of CambridgeSoft.

Remaining at the heart of ChemBioOffice 2008 are the three core applications – ChemBioDraw, ChemBio3D and ChemBioViz. The collection also includes desktop versions of CambridgeSoft’s Enterprise applications: E-Notebook, BioAssay, Inventory and access to a number of important online databases such as ChemACX (for up-to-date product information from chemical vendors) and the ChemIndex compound reference database.

ChemBioDraw
ChemBioDraw provides high quality structural drawing, analysis and querying for chemists and offers biologists their own first-class tools for drawing and annotating biological pathways. With integration a key objective, ChemDraw and BioDraw documents use the same native file formats to ensure information is seamlessly communicated between different teams of scientists and easily exported for use in presentations and publications.

ChemBio3D
ChemBio3D provides molecular modelling and eye-catching graphical visualisation of small molecules and proteins involved in chemical and biological processes. For macromolecules ChemBio3D can render cartoon depictions of proteins and nucleic acids making it possible to carry out state-of-the-art protein visualisation on the desktop and provides interfaces to GAMESS, Gaussian, Schrödinger’s Jaguar and the latest MOPAC.

ChemBioViz
ChemBioViz with ChemFinder provides a visualisation tool to correlate chemical data with biological activity. Features include descriptive statistical results which are shown on plots and Compound Profiles – a way of visually comparing and ranking structures based on values of selected properties.

ChemBioScript
Tying these applications together is ChemBioScript, a new chemical Python extension language from CambridgeSoft, which provides a set of classes and methods for working with atoms, bonds and the other properties of molecules, reactions and 3D models.

And More…
In addition to the three core applications, ChemBioOffice 2008 also offers a number of other new and updated components to the suite. E-Notebook Ultra, BioAssay Ultra and Inventory Ultra are designed to deliver much of the functionality of CambridgeSoft’s enterprise level applications of these products to individual scientists at their desktops.

With offices in the UK, USA, Germany and throughout the Nordic region, Adept Scientific is one of the world’s leading suppliers of software and hardware products for research, scientific, engineering and technical applications on desktop computers.

For the time being we are unable to offer the following product ranges although we are currently working hard to increase the number of products we can offer in the future. Please contact us to talk about alternative products that we may be able to offer you.