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• W2740371351 abstract "This chapter describes a protocol to establish a three-dimensional (3D) model of a protein and to explore its conformational landscape. It combines predictions from up-to-date bioinformatics methods with low-resolution experimental data. It also proposes to examine rapidly the dynamics of the protein using molecular dynamics simulations with a coarse-grained force field. Tools for analyzing these trajectories are suggested as well as those for constructing all-atoms models. Thus, starting from a protein sequence and using free software, the user can get important conformational information, which might improve the knowledge about the protein function." @default.
• W2740371351 created "2017-08-08" @default.
• W2740371351 creator A5029541625 @default.
• W2740371351 creator A5034036609 @default.
• W2740371351 date "2017-01-01" @default.
• W2740371351 modified "2023-10-01" @default.
• W2740371351 title "Molecular Modeling of Transporters: From Low Resolution Cryo-Electron Microscopy Map to Conformational Exploration. The Example of TSPO" @default.
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• W2740371351 doi "https://doi.org/10.1007/978-1-4939-7151-0_21" @default.
• W2740371351 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/28755381" @default.
• W2740371351 hasPublicationYear "2017" @default.
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