Search Results - "Leite, Vitor BP"
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Capturing Transition Paths and Transition States for Conformational Rearrangements in the Ribosome
Published in Biophysical journal (16-12-2014)“…To reveal the molecular determinants of biological function, one seeks to characterize the interactions that are formed in conformational and chemical…”
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Topography of funneled landscapes determines the thermodynamics and kinetics of protein folding
Published in Proceedings of the National Academy of Sciences - PNAS (25-09-2012)“…The energy landscape approach has played a fundamental role in advancing our understanding of protein folding. Here, we quantify protein folding energy…”
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Capturing Transition Paths and Transition States for Conformational Rearrangements in the Ribosome
Published in Biophysical journal (16-12-2014)“…Microtubule diversity, arising from the utilization of different tubulin genes and from posttranslational modifications, regulates many cellular processes…”
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Analyzing the effect of homogeneous frustration in protein folding
Published in Proteins, structure, function, and bioinformatics (01-10-2013)“…ABSTRACT The energy landscape theory has been an invaluable theoretical framework in the understanding of biological processes such as protein folding,…”
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Configuration-Dependent Diffusion Dynamics of Downhill and Two-State Protein Folding
Published in The journal of physical chemistry. B (03-05-2012)“…Configuration-dependent diffusion (CDD) is important for protein folding kinetics with small thermodynamic barriers. CDD can be even more crucial in downhill…”
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Supervised Variational Relevance Learning, An Analytic Geometric Feature Selection with Applications to Omic Datasets
Published in IEEE/ACM transactions on computational biology and bioinformatics (01-05-2015)“…We introduce Supervised Variational Relevance Learning (Suvrel), a variational method to determine metric tensors to define distance based similarity in…”
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Inferring a weighted elastic network from partial unfolding with coarse-grained simulations
Published in Proteins, structure, function, and bioinformatics (01-01-2014)“…ABSTRACT A number of studies have demonstrated that simple elastic network models can reproduce experimental B‐factors, providing insights into the…”
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The Origin of Nonmonotonic Complex Behavior and the Effects of Nonnative Interactions on the Diffusive Properties of Protein Folding
Published in Biophysical journal (21-07-2010)“…We present a method for calculating the configurational-dependent diffusion coefficient of a globular protein as a function of the global folding process…”
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Assembling a xylanasealichenase chimera through all-atom molecular dynamics simulations
Published in Biochimica et biophysica acta. Proteins and proteomics (01-08-2013)“…Multifunctional enzyme engineering can improve enzyme cocktails for emerging biofuel technology. Molecular dynamics through structure-based models (SB) is an…”
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