Comparative modelling by restraint-based conformational sampling
نویسندگان
چکیده
منابع مشابه
Conformational Sampling by Self-Organization
A new stochastic algorithm for conformational sampling is described. The algorithm generates molecular conformations that are consistent with a set of geometric constraints, which include interatomic distance bounds and chiral volumes derived from the molecular connectivity table. The algorithm repeatedly selects individual geometric constraints at random and updates the respective atomic coord...
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ژورنال
عنوان ژورنال: BMC Structural Biology
سال: 2008
ISSN: 1472-6807
DOI: 10.1186/1472-6807-8-7