CAChe Research Computer-Aided Chemistry & Biochemistry
News and Events News
ACS Workshop: Next Generation Modeling & QSAR
Presented by Prof. Tim Clark & Prof. Jürgen Brickmann. Room 104A, Pennsylvania
Convention Center, 6pm - 8pm, Tuesday 21st August 2012
OpenTox: An open-source web-service platform for toxicity prediction(ACS Presentation) David A Gallagher, Sunil Chawla, Barry Hardy, Wed. 30th March 2011, Anaheim, CA, USA On-line ACS recording (slides & audio, 30mins)click "VIEW" button to start
COSMOtherm wins Sixth Industrial Fluid Properties Simulation Challenge (again)
Announced at AIChE in Salt Lake City, Tuesday 9th November 2010
COSMO-RS Symposium proceedings, Germany, 31 March - 1 April 2009 OpenTox - an EC funded FP7 Research Project (1 September 2008 - 2011) OpenTox is a EC funded project to create an open source framework
and unified access to toxicity data and QSAR (quantitative structure-
activity relationships) models with supporting validation and
interpretation. Barry Hardy of Douglas Connect in Basel, Switzerland, is managing the project and
coordinating the consortium of QSAR specialists which includes David Gallagher of CAChe
Research. OpenTox will address aspects of the REACH legislation and will extend access
to non-animal-testing methods for toxicologists and other scientists who are not experts in QSAR.
_________________________________________________________________________________ Events ACS, New Oleans, LA, 7-11 April 2013 CAChe Research will be exhibiting COSMOtherm, Turbomole, MOPAC, ParaSurf, & ParaFit
