Quantum mechanical simulation methods for studying biological systems : Les Houches Workshop, May 2-7, 1995 - Bicout, Dominique; Field, Martin (Berlin ; New York : Springer-Verlag ; Les Ulis : Les Editions de Physique ; Cambridge, MA : PCG Inc., 1996)
Lecture 9. The photodetachment of an electron from a chloride ion in water studied by quantum molecular dynamics simulation / A. Staib and D. Borgis -- Lecture 10. Quantum chemistry of in situ retinal: study of the spectral properties and dark adaptation of Bacteriorhodopsin / I. Logunov and K. Schulten -- Lecture 11. Towards an understanding of quantum factors in small ligand geminate recombination to heme proteins / W. Nowak and J.-L. Martin -- Lecture 12. A parallel direct SCF method for large molecular systems / T. R. Furlani and H. F. King -- Lecture 13. Multigrid electrostatic computations in density functional theory / M. P. Merrick, K. A. Iyer and T. L. Beck -- Lecture 14. Symmetry-oriented research of polymers PC program POLSym and DNA / I. Milosevic, A. Damjanovic and M. Damnjanovic.
Includes bibliographical references.
Keywords: Biomolecules -- Structure -- Computer simulation -- Congresses; Biomolecules -- Structure -- Mathematical models -- Congresses; Proteins -- Structure -- Computer simulation -- Congresses; Proteins -- Structure -- Mathematical models -- Congresses; Structure-activity relationships (Biochemistry) -- Congresses