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Biochimica Et Biophysica Acta|March 14, 1991
Thermodynamic analysis of the equilibrium, association and dissociation of 2'GMP and 3'GMP with ribonuclease T1 at pH 5.3A D MacKerell, R Rigler, U Hahn, et al.Biophysical Chemistry|May 9, 1987
Protein dynamics. A time-resolved fluorescence, energetic and molecular dynamics study of ribonuclease T1A D MacKerell, R Rigler, L Nilsson, et al.Biophysical Journal|November 25, 1997
Molecular dynamics simulation of unsaturated lipid bilayers at low hydration: parameterization and comparison with diffraction studiesS E Feller, D Yin, R W Pastor, et al.Regulatory Peptides|June 1, 1989
Analysis of structure-function relationships of neuropeptide Y using molecular dynamics simulations and pharmacological activity and binding measurementsA D MacKerell, A Hemsén, J S Lacroix, et al.European Biophysics Journal : EBJ|January 1, 1988
Molecular dynamics simulations of ribonuclease T1. Effect of solvent on the interaction with 2'GMPA D MacKerell, R Rigler, L Nilsson, et al.Proteins|January 1, 1989
Molecular dynamics simulations of ribonuclease T1: comparison of the free enzyme and the 2' GMP-enzyme complexA D MacKerell, L Nilsson, R Rigler, et al.Nucleic Acids Research|June 28, 2000
New insights into the structure of abasic DNA from molecular dynamics simulationsD Barsky, N Foloppe, S Ahmadia, et al.Biochemistry|September 8, 1987
Active site of human liver aldehyde dehydrogenaseD P Abriola, R Fields, S Stein, et al.Proceedings of the National Academy of Sciences of the United States of America|April 16, 1996
Progress toward chemical accuracy in the computer simulation of condensed phase reactionsP A Bash, L L Ho, A D MacKerell, et al.Journal of Medicinal Chemistry|April 4, 1998
(-)-3 beta-Substituted ecgonine methyl esters as inhibitors for cocaine binding and dopamine uptakeS F Lieske, B Yang, M E Eldefrawi, et al.Pageof 4