We describe a new sketch recognition framework for chemical structure drawings that combines multiple levels of visual features using a jointly trained conditional random field. ...
GREAT-ER (Geography-referenced Regional Exposure Assessment Tool for European Rivers) is a model system for predicting chemical fate and exposure in surface waters. The GREAT-ER a...
F. Koormann, J. Rominger, D. Schowanek, J.-O. Wagn...
One of the greatest challenges in computational chemistry is the design of enzymes to catalyze non-natural chemical reactions. We focus on harnessing the distributed parallel comp...
Jianwu Wang, Prakashan Korambath, Seonah Kim, Scot...
ion visualization is valuable in learning abstract ideas and new concepts. The existing technology for publishing online papers is lacking in terms of user interaction as well as ...
A novel asynchronous collaborative visualization system for the chemical sciences has been created as a mash-up between an interactive visualization program and a wiki. The system...