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020 _a9783031059148
_9978-3-031-05914-8
024 7 _a10.1007/978-3-031-05914-8
_2doi
050 4 _aQH324.2-324.25
072 7 _aUY
_2bicssc
072 7 _aPS
_2bicssc
072 7 _aCOM082000
_2bisacsh
072 7 _aPSAX
_2thema
082 0 4 _a570.285
_223
245 1 0 _aAlgorithms and Methods in Structural Bioinformatics
_h[electronic resource] /
_cedited by Nurit Haspel, Filip Jagodzinski, Kevin Molloy.
250 _a1st ed. 2022.
264 1 _aCham :
_bSpringer International Publishing :
_bImprint: Springer,
_c2022.
300 _aIX, 114 p. 51 illus., 37 illus. in color.
_bonline resource.
336 _atext
_btxt
_2rdacontent
337 _acomputer
_bc
_2rdamedia
338 _aonline resource
_bcr
_2rdacarrier
347 _atext file
_bPDF
_2rda
490 1 _aComputational Biology,
_x2662-2432
505 0 _a1. Protein-Ligand Binding with Applications in Molecular Docking -- 2. Explaining Small Molecule Binding Specificity with Volumetric Representations of Protein Binding Sites -- 3. Machine Learning-based Approaches for Protein Conformational Exploration -- 4. Low Rank Approximation Methods for identifying Impactful Pairwise Protein Mutations -- 5. Detection and analysis of amino acid insertions and deletions -- 6. DeepTracerWeb Service for Fast and Accurate De Novo Protein Complex Structure Prediction from Cryo-EM.
520 _aThe three-dimensional structure and function of molecules present many challenges and opportunities for developing an understanding of biological systems. With the increasing availability of molecular structures and the advancing accuracy of structure predictions and molecular simulations, the space for algorithmic advancement on many analytical and predictive problems is both broad and deep. To support this field, a rich set of methods and algorithms are available, addressing a variety of important problems such as protein-protein interactions, the effect of mutations on protein structure and function, and protein structure determination. Despite recent advancements in the field, in particular in protein folding with the development of AlphaFold, many problems still remain unsolved. In this book we focus on a number of topics in Structural Bioinformatics: Cryo-EM structural detection, protein conformational exploration, elucidation of molecular binding surface using geometry, the effect of mutations, insertions and deletions on protein structural stability, and protein-ligand binding.
650 0 _aBioinformatics.
650 0 _aMedical informatics.
650 1 4 _aBioinformatics.
650 2 4 _aHealth Informatics.
700 1 _aHaspel, Nurit.
_eeditor.
_4edt
_4http://id.loc.gov/vocabulary/relators/edt
700 1 _aJagodzinski, Filip.
_eeditor.
_4edt
_4http://id.loc.gov/vocabulary/relators/edt
700 1 _aMolloy, Kevin.
_eeditor.
_4edt
_4http://id.loc.gov/vocabulary/relators/edt
710 2 _aSpringerLink (Online service)
773 0 _tSpringer Nature eBook
776 0 8 _iPrinted edition:
_z9783031059131
776 0 8 _iPrinted edition:
_z9783031059155
776 0 8 _iPrinted edition:
_z9783031059162
830 0 _aComputational Biology,
_x2662-2432
856 4 0 _uhttps://doi.org/10.1007/978-3-031-05914-8
912 _aZDB-2-SCS
912 _aZDB-2-SXCS
942 _cSPRINGER
999 _c173523
_d173523