– Revolutionary computer-aided retro-synthesis software optimizes productivity, organic synthesis – Complements MilliporeSigma’s leading e-commerce platform and chemistry portfolio of more than 400,000 building blocks, catalysts and reagents for chemical synthesis This image illustrates the synthetic pathways a researcher using Chematica might be given. Each burst represents the viable reaction options. The connections between the bursts […]

– Revolutionary computer-aided retro-synthesis software optimizes productivity, organic synthesis – Complements MilliporeSigma’s leading e-commerce platform and chemistry portfolio of more than 400,000 building blocks, catalysts and reagents for chemical synthesis BILLERICA, Mass. — MilliporeSigma today announced the acquisition of Grzybowski Scientific Inventions (GSI), a company that developed the revolutionary computer-aided retro-synthesis tool, Chematica. Chematica uses advanced reaction […]

Goldfinch Bio’s researchers select StarDrop to guide successful drug discovery CAMBRIDGE, UK and CAMBRIDGE, MA – Optibrium, a developer of software for small molecule discovery, and Goldfinch Bio, a company focused on discovering and developing precision therapies to treat patients with kidney disease, today announced that the company has signed a multi-year agreement to license Optibrium’s […]

Drug discovery software specialists combine expertise to extend studies into drug metabolism modelling CAMBRIDGE and LEEDS, UK – Optibrium™ and Lhasa Limited (Lhasa), developers of software for small molecule property prediction, design and optimisation, announced today they have formed a collaborative partnership to research next generation drug metabolism modelling. Results from the work will be […]

Graphical workflow environment lets scientists easily build and execute data processing workflows BISHOP’S STORTFORD, England – Dotmatics, a leading provider of scientific informatics solutions and services, today announced Reaction Workflows (RW), a major new application within the Dotmatics 5.1 suite that lets scientists quickly and easily define and execute common cheminformatics tasks, such as library enumeration, structure normalization and compound […]

ACD/Labs NMR prediction software implemented as a learning tool for the power of first principle in computational chemistry at the University of Waterloo ENC 2017, Pacific Grove, CA—ACD/Labs, an informatics company that develops and commercializes solutions in support of chemical and pharmaceutical R&D, today announced a collaboration with Dr. Jacob Fisher, a laboratory instructor at […]

Company Also Extends Metabolomics Capabilities with Addition to Progenesis Software CHICAGO–Waters Corporation (NYSE:WAT) today at the annual Pittcon Conference and Expo announced the launch of Empower® Cloud, a cloud deployable, compliance ready enterprise Chromatography Data Software (CDS). Additionally, TA Instruments introduced the new Discovery Simultaneous Differential Scanning Calorimeter/Thermogravimetric Analyzer, the SDT 650. TA also released […]

LUMINATA™ offers a single system for organizing live, assembled analytical data for impurities within the context of a substance and the process by which it was made CHICAGO–PITTCON 2017—ACD/Labs, an informatics company that develops and commercializes solutions in support of chemical and pharmaceutical R&D, today announced it will introduce LUMINATA™, an informatics system that enables […]

New partnership gives researchers improved access to Optibrium’s StarDrop with dedicated local support CAMBRIDGE, UK and BENGALURU, INDIA – Optibrium™, a developer of software for small molecule design and optimisation, announced today that it has appointed Zastra Innovations (Zastra) to be its sole distributor in India for StarDrop™, the company’s flagship product. Zastra will provide researchers […]

NEW YORK, NY – Schrödinger Inc. and the Quantum Espresso Foundation are pleased to announce the integration of the QUANTUM ESPRESSO density functional theory (DFT) modeling software into Schrödinger’s Materials Science Suite to enable expanded use of first-principles simulation in industrial and academic research laboratories. The December 2016 release of the Schrödinger Materials Science Suite includes […]