Show simple item record

dc.contributor.authorGroenhof, Gerrit
dc.contributor.authorModi, Vaibhav
dc.contributor.authorMorozov, Dmitry
dc.date.accessioned2020-04-30T08:02:43Z
dc.date.available2020-04-30T08:02:43Z
dc.date.issued2020
dc.identifier.citationGroenhof, G., Modi, V., & Morozov, D. (2020). Observe while it happens : catching photoactive proteins in the act with non-adiabatic molecular dynamics simulations. <i>Current Opinion in Structural Biology</i>, <i>61</i>, 106-112. <a href="https://doi.org/10.1016/j.sbi.2019.12.013" target="_blank">https://doi.org/10.1016/j.sbi.2019.12.013</a>
dc.identifier.otherCONVID_34071802
dc.identifier.urihttps://jyx.jyu.fi/handle/123456789/68788
dc.description.abstractOrganisms use photo-receptors to react to light. The first step is usually the absorption of a photon by a prosthetic group embedded inside the photo-receptor, often a conjugated chromophore. The electronic changes in the chromophore induced by photo-absorption can trigger a cascade of structural or chemical transformations that culminate into a response to light. Understanding how these proteins have evolved to mediate their activation process has remained challenging because the required time and spacial resolutions are notoriously difficult to achieve experimentally. Therefore, mechanistic insights into photoreceptor activation have been predominantly obtained with computer simulations. Here we briefly outline the challenges associated with such computations and review the progress made in this field.en
dc.format.mimetypeapplication/pdf
dc.languageeng
dc.language.isoeng
dc.publisherElsevier Ltd.
dc.relation.ispartofseriesCurrent Opinion in Structural Biology
dc.rightsCC BY-NC-ND 4.0
dc.subject.otherphotoactive proteins
dc.subject.othermolecular biology
dc.titleObserve while it happens : catching photoactive proteins in the act with non-adiabatic molecular dynamics simulations
dc.typearticle
dc.identifier.urnURN:NBN:fi:jyu-202004302995
dc.contributor.laitosKemian laitosfi
dc.contributor.laitosDepartment of Chemistryen
dc.contributor.oppiaineFysikaalinen kemiafi
dc.contributor.oppiainePhysical Chemistryen
dc.type.urihttp://purl.org/eprint/type/JournalArticle
dc.description.reviewstatuspeerReviewed
dc.format.pagerange106-112
dc.relation.issn0959-440X
dc.relation.volume61
dc.type.versionpublishedVersion
dc.rights.copyright© 2020 The Authors. Published by Elsevier Ltd.
dc.rights.accesslevelopenAccessfi
dc.subject.ysoproteiinit
dc.subject.ysomolekyylibiologia
dc.format.contentfulltext
jyx.subject.urihttp://www.yso.fi/onto/yso/p4332
jyx.subject.urihttp://www.yso.fi/onto/yso/p7549
dc.rights.urlhttps://creativecommons.org/licenses/by-nc-nd/4.0/
dc.relation.doi10.1016/j.sbi.2019.12.013
jyx.fundinginformationThis work has been done as part of the BioExcel CoE (www.bioexcel.eu), a project funded by the European Union contracts H2020-INFRAEDI-02-2018-823830, H2020-EINFRA-2015-1-675728.


Files in this item

Thumbnail

This item appears in the following Collection(s)

Show simple item record

CC BY-NC-ND 4.0
Except where otherwise noted, this item's license is described as CC BY-NC-ND 4.0