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Results: 1-10 |
Results: 10
MIGRATION OF IONOPHORES AND SALTS THROUGH A WATER CHLOROFORM LIQUID-LIQUID INTERFACE - MOLECULAR DYNAMICS-POTENTIAL OF MEAN FORCE INVESTIGATIONS
Authors: LAUTERBACH M ENGLER E MUZET N TROXLER L WIPFF G
Citation: M. Lauterbach et al., MIGRATION OF IONOPHORES AND SALTS THROUGH A WATER CHLOROFORM LIQUID-LIQUID INTERFACE - MOLECULAR DYNAMICS-POTENTIAL OF MEAN FORCE INVESTIGATIONS, JOURNAL OF PHYSICAL CHEMISTRY B, 102(1), 1998, pp. 245-256
DO PICRATE ANIONS ATTRACT EACH OTHER IN SOLUTION - MOLECULAR-DYNAMICSSIMULATIONS IN WATER AND IN ACETONITRILE SOLUTIONS
Authors: TROXLER L HARROWFIELD JM WIPFF G
Citation: L. Troxler et al., DO PICRATE ANIONS ATTRACT EACH OTHER IN SOLUTION - MOLECULAR-DYNAMICSSIMULATIONS IN WATER AND IN ACETONITRILE SOLUTIONS, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(34), 1998, pp. 6821-6830
THEORETICAL-STUDIES ON THE UO22-CONTAINING O=PR3 LIGANDS - QM AB-INITIO CALCULATIONS IN THE GAS-PHASE AND MD FEP CALCULATIONS IN AQUEOUS-SOLUTION( AND SR2+ COMPLEXATION BY PHOSPHORYL)
Authors: HUTSCHKA F DEDIEU A TROXLER L WIPFF G
Citation: F. Hutschka et al., THEORETICAL-STUDIES ON THE UO22-CONTAINING O=PR3 LIGANDS - QM AB-INITIO CALCULATIONS IN THE GAS-PHASE AND MD FEP CALCULATIONS IN AQUEOUS-SOLUTION( AND SR2+ COMPLEXATION BY PHOSPHORYL), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(21), 1998, pp. 3773-3781
INTERFACIAL BEHAVIOR OF IONOPHORIC SYSTEMS - MOLECULAR-DYNAMICS STUDIES ON 18-CROWN-6 AND ITS COMPLEXES AT THE WATER-CHLOROFORM INTERFACE
Authors: TROXLER L WIPFF G
Citation: L. Troxler et G. Wipff, INTERFACIAL BEHAVIOR OF IONOPHORIC SYSTEMS - MOLECULAR-DYNAMICS STUDIES ON 18-CROWN-6 AND ITS COMPLEXES AT THE WATER-CHLOROFORM INTERFACE, Analytical sciences, 14(1), 1998, pp. 43-56
THEORETICAL-STUDIES ON TRI-N-BUTYL PHOSPHATE - MD SIMULATIONS IN-VACUO, IN WATER, IN CHLOROFORM, AND AT A WATER CHLOROFORM INTERFACE/
Authors: BEUDAERT P LAMARE V DOZOL JF TROXLER L WIPFF G
Citation: P. Beudaert et al., THEORETICAL-STUDIES ON TRI-N-BUTYL PHOSPHATE - MD SIMULATIONS IN-VACUO, IN WATER, IN CHLOROFORM, AND AT A WATER CHLOROFORM INTERFACE/, Solvent extraction and ion exchange, 16(2), 1998, pp. 597-618
COMPLEXATION OF LN(3-CONTAINING O=PR3 LIGANDS - A QUANTUM-MECHANICS STUDY() LANTHANIDE CATIONS WITH PHOSPHORYL)
Authors: TROXLER L DEDIEU A HUTSCHKA F WIPFF G
Citation: L. Troxler et al., COMPLEXATION OF LN(3-CONTAINING O=PR3 LIGANDS - A QUANTUM-MECHANICS STUDY() LANTHANIDE CATIONS WITH PHOSPHORYL), Journal of molecular structure. Theochem, 431(1-2), 1998, pp. 151-163
ADSORPTION OF IONOPHORES AND OF THEIR CATION COMPLEXES AT THE WATER CHLOROFORM INTERFACE - A MOLECULAR-DYNAMICS STUDY OF A [2.2.2]CRYPTAND AND OF PHOSPHORYL-CONTAINING PODANDS/
Authors: VARNEK A TROXLER L WIPFF G
Citation: A. Varnek et al., ADSORPTION OF IONOPHORES AND OF THEIR CATION COMPLEXES AT THE WATER CHLOROFORM INTERFACE - A MOLECULAR-DYNAMICS STUDY OF A [2.2.2]CRYPTAND AND OF PHOSPHORYL-CONTAINING PODANDS/, Chemistry, 3(4), 1997, pp. 552-560
MD SIMULATIONS ON IONOPHORES AT A WATER-CHLOROFORM INTERFACE .1. CALIX[4]ARENES UNCOMPLEXED AND THE 222-CRYPTAND
Authors: WIPFF G ENGLER E GUILBAUD P LAUTERBACH M TROXLER L VARNEK A
Citation: G. Wipff et al., MD SIMULATIONS ON IONOPHORES AT A WATER-CHLOROFORM INTERFACE .1. CALIX[4]ARENES UNCOMPLEXED AND THE 222-CRYPTAND, New journal of chemistry, 20(4), 1996, pp. 403-417
THE STATIS METHOD - CHARACTERIZATION OF CONFORMATIONAL STATES OF FLEXIBLE MOLECULES FROM MOLECULAR-DYNAMICS SIMULATIONS IN SOLUTION
Authors: COQUET R TROXLER L WIPFF G
Citation: R. Coquet et al., THE STATIS METHOD - CHARACTERIZATION OF CONFORMATIONAL STATES OF FLEXIBLE MOLECULES FROM MOLECULAR-DYNAMICS SIMULATIONS IN SOLUTION, Journal of molecular graphics, 14(4), 1996, pp. 206-212
CONFORMATION AND DYNAMICS OF 18-CROWN-6, CRYPTAND-222, AND THEIR CATION COMPLEXES IN ACETONITRILE STUDIED BY MOLECULAR-DYNAMICS SIMULATIONS
Authors: TROXLER L WIPFF G
Citation: L. Troxler et G. Wipff, CONFORMATION AND DYNAMICS OF 18-CROWN-6, CRYPTAND-222, AND THEIR CATION COMPLEXES IN ACETONITRILE STUDIED BY MOLECULAR-DYNAMICS SIMULATIONS, Journal of the American Chemical Society, 116(4), 1994, pp. 1468-1480
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