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International Journal of Peptide and Protein Research|April 1, 1989
Calculating three-dimensional molecular structure from atom-atom distance information: cyclosporin AJ Lautz, H Kessler, J M Blaney, et al.Journal of Biomolecular NMR|January 1, 1993
Structure refinement using time-averaged J-coupling constant restraintsA E Torda, R M Brunne, T Huber, et al.Journal of Molecular Biology|March 5, 1985
A protein structure from nuclear magnetic resonance data. lac repressor headpieceR Kaptein, E R Zuiderweg, R M Scheek, et al.Journal of the American Chemical Society|July 18, 2001
The beta-peptide hairpin in solution: conformational study of a beta-hexapeptide in methanol by NMR spectroscopy and MD simulationX Daura, K Gademann, H Schäfer, et al.Proteins|September 1, 1995
Structure and internal dynamics of the bovine pancreatic trypsin inhibitor in aqueous solution from long-time molecular dynamics simulationsR M Brunne, K D Berndt, P Güntert, et al.Journal of Molecular Biology|December 5, 1993
A structure refinement method based on molecular dynamics in four spatial dimensionsR C van Schaik, H J Berendsen, A E Torda, et al.Journal of Biomolecular NMR|January 5, 2005
Validation of the GROMOS force-field parameter set 45Alpha3 against nuclear magnetic resonance data of hen egg lysozymeT A Soares, X Daura, C Oostenbrink, et al.Biochimie|July 1, 1985
Determination of protein structures from nuclear magnetic resonance data using a restrained molecular dynamics approach: the lac repressor DNA binding domainE R Zuiderweg, R M Scheek, R Boelens, et al.Biopolymers|October 1, 1990
On the dependence of molecular conformation on the type of solvent environment: a molecular dynamics study of cyclosporin AJ Lautz, H Kessler, W F van Gunsteren, et al.Journal of Molecular Biology|February 17, 1995
Internal mobility of the basic pancreatic trypsin inhibitor in solution: a comparison of NMR spin relaxation measurements and molecular dynamics simulationsP E Smith, R C van Schaik, T Szyperski, et al.Pageof 37