000834630 001__ 834630
000834630 005__ 20240625095112.0
000834630 0247_ $$2doi$$a10.1016/j.jmgm.2016.11.008
000834630 0247_ $$2ISSN$$a1093-3263
000834630 0247_ $$2ISSN$$a1873-4243
000834630 0247_ $$2WOS$$aWOS:000394062800020
000834630 037__ $$aFZJ-2017-04538
000834630 082__ $$a540
000834630 1001_ $$00000-0003-3246-8989$$aQuan, Chaoyu$$b0
000834630 245__ $$aMeshing molecular surfaces based on analytical implicit representation
000834630 260__ $$aNew York, NY [u.a.]$$bElsevier$$c2017
000834630 3367_ $$2DRIVER$$aarticle
000834630 3367_ $$2DataCite$$aOutput Types/Journal article
000834630 3367_ $$0PUB:(DE-HGF)16$$2PUB:(DE-HGF)$$aJournal Article$$bjournal$$mjournal$$s1499669802_7972
000834630 3367_ $$2BibTeX$$aARTICLE
000834630 3367_ $$2ORCID$$aJOURNAL_ARTICLE
000834630 3367_ $$00$$2EndNote$$aJournal Article
000834630 520__ $$aWe develop an algorithm for meshing molecular surfaces that is based on patch-wise meshing using an advancing-front method adapted to the particular case of molecular surfaces. We focus on the solvent accessible surface (SAS) and the solvent excluded surface (SES). The essential ingredient is a newly developed analysis of such surfaces in [18] that allows to describe all SES-singularities a priori and therefore a complete characterization of the SES. In addition, an algorithm for filling molecular inner holes is proposed based on the pre-computed data structures of molecular surfaces.
000834630 536__ $$0G:(DE-HGF)POF3-574$$a574 - Theory, modelling and simulation (POF3-574)$$cPOF3-574$$fPOF III$$x0
000834630 588__ $$aDataset connected to CrossRef
000834630 7001_ $$0P:(DE-Juel1)169312$$aStamm, Benjamin$$b1$$eCorresponding author
000834630 773__ $$0PERI:(DE-600)1491488-8$$a10.1016/j.jmgm.2016.11.008$$gVol. 71, p. 200 - 210$$p200 - 210$$tJournal of molecular graphics and modelling$$v71$$x1093-3263$$y2017
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.pdf$$yRestricted
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.gif?subformat=icon$$xicon$$yRestricted
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.jpg?subformat=icon-1440$$xicon-1440$$yRestricted
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.jpg?subformat=icon-180$$xicon-180$$yRestricted
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.jpg?subformat=icon-640$$xicon-640$$yRestricted
000834630 8564_ $$uhttps://juser.fz-juelich.de/record/834630/files/1-s2.0-S1093326316302327-main.pdf?subformat=pdfa$$xpdfa$$yRestricted
000834630 909CO $$ooai:juser.fz-juelich.de:834630$$pVDB
000834630 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)169312$$aForschungszentrum Jülich$$b1$$kFZJ
000834630 9131_ $$0G:(DE-HGF)POF3-574$$1G:(DE-HGF)POF3-570$$2G:(DE-HGF)POF3-500$$3G:(DE-HGF)POF3$$4G:(DE-HGF)POF$$aDE-HGF$$bKey Technologies$$lDecoding the Human Brain$$vTheory, modelling and simulation$$x0
000834630 9141_ $$y2017
000834630 915__ $$0StatID:(DE-HGF)0420$$2StatID$$aNationallizenz
000834630 915__ $$0StatID:(DE-HGF)0100$$2StatID$$aJCR$$bJ MOL GRAPH MODEL : 2015
000834630 915__ $$0StatID:(DE-HGF)0200$$2StatID$$aDBCoverage$$bSCOPUS
000834630 915__ $$0StatID:(DE-HGF)0300$$2StatID$$aDBCoverage$$bMedline
000834630 915__ $$0StatID:(DE-HGF)0310$$2StatID$$aDBCoverage$$bNCBI Molecular Biology Database
000834630 915__ $$0StatID:(DE-HGF)0600$$2StatID$$aDBCoverage$$bEbsco Academic Search
000834630 915__ $$0StatID:(DE-HGF)0030$$2StatID$$aPeer Review$$bASC
000834630 915__ $$0StatID:(DE-HGF)0199$$2StatID$$aDBCoverage$$bThomson Reuters Master Journal List
000834630 915__ $$0StatID:(DE-HGF)0110$$2StatID$$aWoS$$bScience Citation Index
000834630 915__ $$0StatID:(DE-HGF)0150$$2StatID$$aDBCoverage$$bWeb of Science Core Collection
000834630 915__ $$0StatID:(DE-HGF)0111$$2StatID$$aWoS$$bScience Citation Index Expanded
000834630 915__ $$0StatID:(DE-HGF)1030$$2StatID$$aDBCoverage$$bCurrent Contents - Life Sciences
000834630 915__ $$0StatID:(DE-HGF)1050$$2StatID$$aDBCoverage$$bBIOSIS Previews
000834630 915__ $$0StatID:(DE-HGF)9900$$2StatID$$aIF < 5
000834630 920__ $$lyes
000834630 9201_ $$0I:(DE-Juel1)IAS-5-20120330$$kIAS-5$$lComputational Biomedicine$$x0
000834630 9201_ $$0I:(DE-Juel1)INM-9-20140121$$kINM-9$$lComputational Biomedicine$$x1
000834630 980__ $$ajournal
000834630 980__ $$aVDB
000834630 980__ $$aI:(DE-Juel1)IAS-5-20120330
000834630 980__ $$aI:(DE-Juel1)INM-9-20140121
000834630 980__ $$aUNRESTRICTED