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- W2095355497 abstract "In this review, I describe and discuss new directions in the design of macromolecular simulations. The emphasis is placed on new approaches that have not (as yet) received broad acceptance. First, simplified simulation methods are discussed. Approximations described in this overview include the memory-associated hamiltonian, secondary structure representation of a protein, and continuum solvent models for hydrophobicity. Second, I discuss work pertaining to optimization questions. Novel techniques for overcoming the multiple minima problems in energy minimization of biological macromolecules are gaining considerable momentum. The basic principles of the new algorithms are outlined and future hopes are considered." @default.
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- W2095355497 date "1993-04-01" @default.
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- W2095355497 title "New simulation methods for proteins and DNA" @default.
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- W2095355497 doi "https://doi.org/10.1016/s0959-440x(05)80161-7" @default.
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