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Journal of Molecular Graphics & Modelling|May 31, 2001
State of the art in studying protein folding and protein structure prediction using molecular dynamics methodsM R Lee, Y Duan, P A KollmanJournal of Medicinal Chemistry|March 12, 1999
Prediction of the binding free energies of new TIBO-like HIV-1 reverse transcriptase inhibitors using a combination of PROFEC, PB/SA, CMC/MD, and free energy calculationsM A Eriksson, J Pitera, P A KollmanAnnals of the New York Academy of Sciences|January 1, 1981
Theoretical studies of the structure and energies of base-paired nucleotides and the dissociation kinetics of a proflavine-dinucleotide complexP A Kollman, P K Weiner, A DearingNIDA Research Monograph|January 1, 1978
Quantitative structure-activity relationships in the 2,4,5-ring substituted phenylisopropylaminesG M Anderson, N Castagnoli, P A kollmanJournal of Biomolecular Structure & Dynamics|April 27, 1999
A modified version of the Cornell et al. force field with improved sugar pucker phases and helical repeatT E Cheatham, P Cieplak, P A KollmanBiopolymers|February 15, 1991
Molecular dynamics simulations of small peptides: dependence on dielectric model and pHV Daggett, P A Kollman, I D KuntzJournal of the American Chemical Society|July 18, 2001
2.1 and 1.8 A average C(alpha) RMSD structure predictions on two small proteins, HP-36 and s15M R Lee, D Baker, P A KollmanProteins|May 17, 2000
Use of MM-PB/SA in estimating the free energies of proteins: application to native, intermediates, and unfolded villin headpieceM R Lee, Y Duan, P A KollmanNucleic Acids Research|January 11, 2000
Molecular dynamics studies of the HIV-1 TAR and its complex with argininamideR Nifosì, C M Reyes, P A KollmanProtein Science : a Publication of the Protein Society|August 1, 1994
A negative electrostatic determinant mediates the association between the Escherichia coli trp repressor and its operator DNAJ Guenot, R J Fletterick, P A KollmanPageof 14