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Biochemistry|March 22, 2001
Direct comparison of experimental and calculated folding free energies for hydrophobic deletion mutants of chymotrypsin inhibitor 2: free energy perturbation calculations using transition and denatured states from molecular dynamics simulations of unfoldingY Pan, V DaggettBiochemistry|June 13, 1995
pH-dependent conformations of the amyloid beta(1-28) peptide fragment explored using molecular dynamicsK Kirshenbaum, V DaggettJournal of Molecular Biology|February 19, 1998
Molecular dynamics simulation of the unfolding of barnase: characterization of the major intermediateA Li, V DaggettBiochemistry|June 13, 1995
Sequence effects on the conformational properties of the amyloid beta (1-28) peptide: testing a proposed mechanism for the alpha-->beta transitionK Kirshenbaum, V DaggettProceedings of the National Academy of Sciences of the United States of America|January 5, 2000
Staphylococcal protein A: unfolding pathways, unfolded states, and differences between the B and E domainsD O Alonso, V DaggettJournal of Molecular Biology|March 31, 1995
Molecular dynamics simulations of protein unfolding and limited refolding: characterization of partially unfolded states of ubiquitin in 60% methanol and in waterD O Alonso, V DaggettBiochemistry|August 1, 1995
Molecular dynamics simulation of cytochrome b5: implications for protein-protein recognitionE M Storch, V DaggettJournal of Molecular Biology|November 25, 1998
Non-native interactions in protein folding intermediates: molecular dynamics simulations of hen lysozymeS L Kazmirski, V DaggettProtein Engineering|August 1, 1990
Molecular dynamics simulations of active site mutants of triosephosphate isomeraseV Daggett, P A KollmanBiochemistry|September 10, 1996
Structural consequences of heme removal: molecular dynamics simulations of rat and bovine apocytochrome b5E M Storch, V DaggettPageof 35