August 2019 newsletter
Sneak peek at Flare V3.0 for structure-based design Giovanna Tedesco gives a sneak peek at some of the new functionality in Flare ...
In this blog post Tim Cheeseright explores some of the new additions in the latest release of Torch and improvements to some old favorites. Almost all of these features are also present in TorchLite – the free version of Torch. Read Analyzing data in Torch V10.4.
Finding bioisosteres sounds like a simple problem: choose the part of the molecule that you want to replace, find replacements that fit the hole and prioritize those that look most like the removed part. However, it’s much more complicated than that! You have to consider conformation, shape, steric strain, electronic effects, hybridization changes and more. In the blog post Bioisosterism – harder than you might think Mark Mackey explains how Spark handles all of these.
Cresset actively supports academic research through flexible licensing terms and software bursaries. Licenses have been created specifically to facilitate internal academic research within a university. The following licensing options are available:
6 October | UK QSAR Autumn Meeting, Duxford, UK
27 October | Chem-Bio Informatics Society Annual Meeting, Tokyo, Japan
8 November | 11th German Conference on Cheminformatics, Fulda, Germany
27 November | Molecular Graphics and Modelling Society young Modellers’ Forum, London, UK