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» Chain Closure: A Problem in Molecular CAD
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92
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DAC
1994
ACM
15 years 2 months ago
Chain Closure: A Problem in Molecular CAD
Conformational analysis is the problem of nding all minimal energy three-dimensional con gurations of molecules. Cyclic structures are of particular interest. An ecient algorithm...
Maria Domenica Di Benedetto, Pasquale Lucibello, A...
97
Voted
JCC
2006
110views more  JCC 2006»
14 years 10 months ago
Using internal and collective variables in Monte Carlo simulations of nucleic acid structures: Chain breakage/closure algorithm
: This article describes a method for solving the geometric closure problem for simplified models of nucleic acid structures by using the constant bond lengths approximation. The r...
Heinz Sklenar, Daniel Wüstner, Remo Rohs