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2005

Conference Publication

Simulations of phase transformations of lipid-water mixtures by molecular dynamics

de Vries, AH, Knecht, V, Yefimov, S, Mark, AE and Marrink, SI (2005). Simulations of phase transformations of lipid-water mixtures by molecular dynamics. 230th National Meeting of the American-Chemical-Society, Washington Dc, Aug 28-Sep 01, 2005. WASHINGTON: AMER CHEMICAL SOC.

Simulations of phase transformations of lipid-water mixtures by molecular dynamics

2005

Conference Publication

Effect of distal mutations on the molecular dynamics of the HIV-1 protease

Kovalskyy, DB, Dubina, VM, Mark, AE and Kornelyuk, AI (2005). Effect of distal mutations on the molecular dynamics of the HIV-1 protease. IUBMB 50th Anniversary Symposium, Budapest Hungary, Jul 02-07, 2005. OXFORD: BLACKWELL PUBLISHING.

Effect of distal mutations on the molecular dynamics of the HIV-1 protease

2005

Conference Publication

Coarse grained simulation of phase transitions of lipid membranes

Marrink, SJ and Mark, AE (2005). Coarse grained simulation of phase transitions of lipid membranes. 49th Annual Meeting of the Biopysical-Society, Long Beach Ca, Feb 12-16, 2005. BETHESDA: BIOPHYSICAL SOCIETY.

Coarse grained simulation of phase transitions of lipid membranes

2005

Conference Publication

A structural model for low pH mediated viral fusion: The role of histidine protonation

Kampmann, T., Muller, D. A., Robinson, J., Mark, A., Young, P. R. and Kobe, B. (2005). A structural model for low pH mediated viral fusion: The role of histidine protonation. 3rd Australian Virology Group Meeting, Phillip Island, 9-12 Dec, 2005.

A structural model for low pH mediated viral fusion: The role of histidine protonation

2005

Conference Publication

Simulation studies of self-organization in lipid systems

Knecht, V, Marrink, SJ and Mark, AE (2005). Simulation studies of self-organization in lipid systems. 49th Annual Meeting of the Biopysical-Society, Long Beach Ca, Feb 12-16, 2005. BETHESDA: BIOPHYSICAL SOCIETY.

Simulation studies of self-organization in lipid systems

1995

Conference Publication

Free energy calculations in drug design: A practical guide

Mark, AE and Vangunsteren, WF (1995). Free energy calculations in drug design: A practical guide. 9th International Round Table of the Rhone-Poulenc-Rorer-Foundation on New Perspectives in Drug Design, Turnberry Scotland, Apr, 1994. LONDON: ACADEMIC PRESS LTD.

Free energy calculations in drug design: A practical guide

1992

Conference Publication

Computer-Simulation of Biomolecules - Comparison with Experimental-Data

Vangunsteren, WF, Brunne, RM, Mark, AE and Vanhelden, SP (1992). Computer-Simulation of Biomolecules - Comparison with Experimental-Data. Nato Advanced Research Workshop On the Role of Computational Models and Theories in Biotechnology, Sant Feliu Guixols Spain, Jun 13-19, 1991. DORDRECHT: KLUWER ACADEMIC PUBL.

Computer-Simulation of Biomolecules - Comparison with Experimental-Data

1992

Conference Publication

Molecular-Dynamics and Free-Energy Perturbation Calculations On Complexes of Alpha-Cyclodextrins with P-Substituted Phenols, a Comparison Between Experiment and Simulation

Vanhelden, SP, Vaneijck, BP, Mark, AE, Vangunsteren, WF and Janssen, Lhm (1992). Molecular-Dynamics and Free-Energy Perturbation Calculations On Complexes of Alpha-Cyclodextrins with P-Substituted Phenols, a Comparison Between Experiment and Simulation. 6Th International Symp On Cyclodextrins, Chicago Il, Apr 21-24, 1992. PARIS: EDITIONS DE SANTE.

Molecular-Dynamics and Free-Energy Perturbation Calculations On Complexes of Alpha-Cyclodextrins with P-Substituted Phenols, a Comparison Between Experiment and Simulation