검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
COSMOperm: Mechanistic Prediction of Passive Membrane Permeability for Neutral Compounds and Ions and Its pH Dependence Schwobel JAH, Ebert A, Bittermann K, Huniar U, Goss KU, Klamt A Journal of Physical Chemistry B, 124(16), 3343, 2020 |
| 2 |
Prediction of Phospholipid-Water Partition Coefficients of Ionic Organic Chemicals Using the Mechanistic Model COSMOmic Bittermann K, Spycher S, Endo S, Pohler L, Huniar U, Goss KU, Klamt A Journal of Physical Chemistry B, 118(51), 14833, 2014 |
| 3 |
COSMOmic: A mechanistic approach to the calculation of membrane-water partition coefficients and internal distributions within membranes and micelles Klamt A, Huniar U, Spycher S, Keldenich J Journal of Physical Chemistry B, 112(38), 12148, 2008 |
| 4 |
Density functional theory calculations and exploration of a possible mechanism of N-2 reduction by nitrogenase Huniar U, Ahlrichs R, Coucouvanis D Journal of the American Chemical Society, 126(8), 2588, 2004 |