Ontology highlight
ABSTRACT:
SUBMITTER: Knight CJ
PROVIDER: S-EPMC4489308 | biostudies-literature | 2015 Jul
REPOSITORIES: biostudies-literature
Knight Christopher J CJ Hub Jochen S JS
Nucleic acids research 20150408 W1
Small- and wide-angle X-ray scattering (SWAXS) has evolved into a powerful tool to study biological macromolecules in solution. The interpretation of SWAXS curves requires their accurate predictions from structural models. Such predictions are complicated by scattering contributions from the hydration layer and by effects from thermal fluctuations. Here, we describe the new web server WAXSiS (WAXS in solvent) that computes SWAXS curves based on explicit-solvent all-atom molecular dynamics (MD) s ...[more]