Data mining of molecular dynamics trajectories of nucleic acids.
Title | Data mining of molecular dynamics trajectories of nucleic acids. |
Publication Type | Journal Article |
Year of Publication | 2006 |
Authors | Noy, Agnes, Meyer Tim, Rueda Manuel, Ferrer Carles, Valencia Antonion, Pérez Alberto, de la Cruz Xavier, López-Bes J M., Pouplana R, Fernandez-Recio J, F Luque Javier, and Orozco Modesto |
Journal | J Biomol Struct Dyn |
Volume | 23 |
Pagination | 447-56 |
Date Published | 2006 Feb |
ISSN | 0739-1102 |
Keywords | Computer Simulation, Data Interpretation, Databases, DNA, Information Storage and Retrieval, Models, Molecular, Nucleic Acid, Nucleic Acid Conformation, Nucleic Acids, Statistical, Thermodynamics |
Abstract | Analysis, storage, and transfer of molecular dynamic trajectories are becoming the bottleneck of computer simulations. In this paper we discuss different approaches for data mining and data processing of huge trajectory files generated from molecular dynamic simulations of nucleic acids. |
DOI | 10.1080/07391102.2006.10507070 |