News/Announcements
Meet COSMOlogic at these conferences next time.
*** Free Fluid-Phase-Thermodynamics and COSMO-RS Course
October 2012 (8. - 12.10.), University of Regensburg
Next COSMOtherm training
September 2012, 4th
at COSMOlogic
4th-COSMO-RS-Symposium 8th - 10th April 2013
February 2012
Andreas Klamt receives professorship in "Physical Chemistry"
January 2012
Prof. Paolo Tosco (University of Turin) spends a 6-month sabbatical at COSMOlogic for a collaboration on the development of 3D-QSAR methods based on COSMO sigma surfaces.
December 2011
COSMOtherm Version C3.0 Revision 12.01 released Release Notes
Publication on hydrogen bond energy prediction by using sigma.
September 2011
Publication on the prediction of polyether-water mixtures
July 2011
COSMOfrag Version 3.3, see Release Notes
TmoleX 3.2 Client
download for free
June 2011
New COSMO and COSMO-RS review has appeared
and is temporarily freely available
May 2011
New cooperation with Prof. Steven Abbott, TCNF
March 2011
November 2010
COSMOtherm is Champion of the Sixth Industrial Fluid Properties Simulation Challenge 2010
October 2010
TmoleX - A graphical user interface for TURBOMOLE Journal of Computational Chemistry
Volume 31, Dec 2010
September 2010
Modelling cellulose solubilities in ionic liquids using COSMO-RS
August 2010
May 2010
COSMOtherm yielded the most accurate blind predictions of the hydration free energies ...more
COSMOtherm Application by BASF Prediction of absolute rate constants for a polymerization reaction in solution.
March 2010
COSMO-RS Article: "Towards a first principles prediction of pKa: COSMO-RS and the cluster-continuum approach."
COSMOmic released!
February 2010
A Case Study in the Pre-Calculation of Henry Coefficients in Chemical Engineering & Technology
COSMO-RS among the best!
January 2010
A new review of COSMO-RS appeared in the first issue of Annual Reviews of Chemical Biochemical Engineering
COSMOtherm in environmental science: correct pKa prediction of PFOA. (PDF)