Practical cheminformatics workflows with mobile apps

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Clark, Alex (2012): Practical cheminformatics workflows with mobile apps. figshare.
http://dx.doi.org/10.6084/m9.figshare.96536
Retrieved 02:59, Sep 16, 2014 (GMT)

Description

In recent years smartphones and tablets have attained sufficient power and sophistication to replace conventional desktop and laptop computers for many tasks. Chemistry software is late to the party, but rapidly catching up. This webinar will explore some of the cheminformatics functionality that can currently be performed using mobile apps. A number of workflow scenarios will be discussed, such as: creating and maintaining chemical data (molecules, reactions, numbers & text); searching chemical databases and utilising the results; structure-aware lab notebooks; visualisation and structure-activity analysis; property calculation using remote webservices; and a multitude of ways to share data collaboratively, and integrate modular apps within distributed and heterogeneous workflows.

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