Cheminformatics


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The field of chemistry that integrates chemical data with analytic and molecular design tools finding the 'best- fitting' compounds to address particular targets; cheminformatics encompasses diversity analysis and library design, virtual screening, rational drug design, and tools and approaches for predicting activity and other properties from structure
References in periodicals archive ?
M2 PHARMA-August 1, 2017-BenevolentAI names Dr Nathan Brown as new head of cheminformatics
BIOVIA's updated decision support tool BIOVIA Insight moves beyond the company's legacy informatics products to provide a next-generation solution for interactive searching, browsing and visualizing data for a variety of disciplines, including cheminformatics, biologics and chemical processes.
Robert Fraczkiewicz, team leader for ADMET Cheminformatics at Simulations Plus, said: "The release of ADMET Predictor 7.
Dotmatics has significant expertise in cheminformatics and bioinformatics techniques including chemical databases, SAR analysis, data management and data visualisation.
Computational approaches in cheminformatics and bioinformatics.
According to the contract, research teams at both companies will work together to explore the technology frontiers in the field of cheminformatics.
The Chemistry Extensions package for the KNIME open-source workflow platform complements KNIME's existing capabilities by providing discovery scientists with access to many important cheminformatics tools, including tools that are used to visualize and transform molecular structures, compute molecular proper ties, and search for functional groups.
Complimenting the power of BONDplus today is the platform's future development path towards additional integration of cheminformatics, patents and publication information", said Unleashed Informatics Co-Founder and Chief Scientific Officer Dr.
ChemAxon is a provider of cheminformatics software development platforms for the biotechnology and pharmaceutical industries.
06 contains new features and developments to its wide range of computational applications, including tools for bioinformatics, cheminformatics, high throughput discovery, protein modelling, and structure-based design.
This reorganization is designed to transform the company into a holding company and consolidate its bioinformatics (SRS) and cheminformatics (LeadNavigator) operations at its Cambridge, UK and Cambridge, Massachusetts sites in order to make the company profitable in 2006.
Scientists can easily build cheminformatics solutions as they require by selecting data sources, supplied components, external tools and web services, integrating them within a single unified cheminformatics infrastructure.
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