Many important molecular conformation problems, such as protein folding, are expressed as global minimization problems. It is the fact that local minimization is insufficient, that markedly differentiates this volume from the previous two. Unfortunately, global minimization problems that result from models of molecular conformation are usually intractable. For example, simple 1-dimensional versions of distance conformation problems are NP-hard. Nevertheless, there has been significant recent progress in the design of promising heuristic strategies (often involving the use of high- performance...
Many important molecular conformation problems, such as protein folding, are expressed as global minimization problems. It is the fact that local mini...
Inverse problems and optimal design have come of age as a consequence of the availability of better, more accurate, and more efficient simulation packages. Many of these simulators, which can run on small workstations, can capture the complicated behavior of the physical systems they are modeling, and have become commonplace tools in engineering and science. There is a great desire to use them as part of a process by which measured field data are analyzed or by which design of a product is automated. A major obstacle in doing precisely this is that one is ultimately confronted with a...
Inverse problems and optimal design have come of age as a consequence of the availability of better, more accurate, and more efficient simulation pack...
