Andreas Klamt
University of Regensburg(DE)
Publications by Year
Research Areas
Phase Equilibria and Thermodynamics, Spectroscopy and Quantum Chemical Studies, Chemical Thermodynamics and Molecular Structure, Computational Drug Discovery Methods, Analytical Chemistry and Chromatography
Most-Cited Works
- → COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient(1993)9,349 cited
- → Conductor-like Screening Model for Real Solvents: A New Approach to the Quantitative Calculation of Solvation Phenomena(1995)4,008 cited
- → Refinement and Parametrization of COSMO-RS(1998)1,945 cited
- → Fast solvent screening via quantum chemistry: COSMO‐RS approach(2002)1,760 cited
- → COSMO-RS: a novel and efficient method for the a priori prediction of thermophysical data of liquids(2000)1,242 cited
- → Treatment of the outlying charge in continuum solvation models(1996)852 cited
- → Incorporation of solvent effects into density functional calculations of molecular energies and geometries