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๐ SIMILAR VOLUMES
A new algorithm, complementarity, is developed for conformational search of macrocyclic molecules. The algorithm scans a large number of candidate conformations and energy-minimizes only the promising ones. These candidates can be generated by two operators that construct new conformations from know
We demonstrate the use of a genetic algorithm (GA) search procedure for finding low-energy conformations of small to medium organic molecules (1-12 rotatable bonds). GAS are in a class of biologically motivated optimization methods that evolve a population of individuals where individuals who are mo
Given a directed graph D=(V, A) and a set S V, a bibranching is a set of arcs B A that contains a v&(V "S) path for every v # S and an S&v path for every v # V "S. In this paper, we describe a primal dual algorithm that determines a minimum weight bibranching in a weighted digraph. It has running ti
In this paper we propose an efficient algorithm to implement parallel integer multiplication by a combination of parallel additions, shifts and reads from a memoryresident lookup table dedicated to squares. Such an operator called PIM (parallel integer multiplication) is in fact microprogrammed at t