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Proteins|May 8, 2001
Comparison of different schemes to treat long-range electrostatic interactions in molecular dynamics simulations of a protein crystalR Walser, P H Hünenberger, W F van GunsterenProteins|February 19, 1999
Folding-unfolding thermodynamics of a beta-heptapeptide from equilibrium simulationsX Daura, W F van Gunsteren, A E MarkJournal of Computer-Aided Molecular Design|December 1, 1994
Local elevation: a method for improving the searching properties of molecular dynamics simulationT Huber, A E Torda, W F van GunsterenProteins|August 1, 1997
Generation of pseudonative protein structures for threadingF A Hamprecht, W Scott, W F van GunsterenProteins|October 12, 2000
Molecular-dynamics simulation of the beta domain of metallothionein with a semi-empirical treatment of the metal coreC D Berweger, W Thiel, W F van GunsterenBiophysical Journal|May 24, 2001
Dielectric properties of proteins from simulation: the effects of solvent, ligands, pH, and temperatureJ W Pitera, M Falta, W F van GunsterenJournal of Molecular Graphics|June 1, 1993
Cooperative effects in the transport of small molecules through an amorphous polymer matrixF Müller-Plathe, L Laaksonen, W F van GunsterenJournal of Biomolecular NMR|September 1, 1995
Structure refinement with molecular dynamics and a Boltzmann-weighted ensembleJ Fennen, A E Torda, W F van GunsterenEuropean Biophysics Journal : EBJ|January 1, 1987
Molecular dynamics simulation of crystalline beta-cyclodextrin dodecahydrate at 293 K and 120 KJ E Koehler, W Saenger, W F van GunsterenProteins|March 1, 1997
Solvent structure at a hydrophobic protein surfaceH Kovacs, A E Mark, W F van GunsterenPageof 37