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<?xml version='1.0' encoding='utf-8'?> <resource xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns="http://datacite.org/schema/kernel-4" xsi:schemaLocation="http://datacite.org/schema/kernel-4 http://schema.datacite.org/meta/kernel-4.1/metadata.xsd"> <identifier identifierType="DOI">10.5281/zenodo.3959198</identifier> <creators> <creator> <creatorName>Vytautas</creatorName> <nameIdentifier nameIdentifierScheme="ORCID" schemeURI="http://orcid.org/">0000-0002-6761-7780</nameIdentifier> <affiliation>Gapsys</affiliation> </creator> <creator> <creatorName>Bert</creatorName> <nameIdentifier nameIdentifierScheme="ORCID" schemeURI="http://orcid.org/">0000-0003-3570-3534</nameIdentifier> <affiliation>de Groot</affiliation> </creator> </creators> <titles> <title>Input files and data for the publication "On the importance of statistics in molecular simulations: thermodynamics, kinetics and simulation box size"</title> </titles> <publisher>Zenodo</publisher> <publicationYear>2020</publicationYear> <dates> <date dateType="Issued">2020-07-24</date> </dates> <resourceType resourceTypeGeneral="Other"/> <alternateIdentifiers> <alternateIdentifier alternateIdentifierType="url">https://zenodo.org/record/3959198</alternateIdentifier> </alternateIdentifiers> <relatedIdentifiers> <relatedIdentifier relatedIdentifierType="DOI" relationType="IsVersionOf">10.5281/zenodo.3959197</relatedIdentifier> </relatedIdentifiers> <rightsList> <rights rightsURI="https://creativecommons.org/licenses/by/4.0/legalcode">Creative Commons Attribution 4.0 International</rights> <rights rightsURI="info:eu-repo/semantics/openAccess">Open Access</rights> </rightsList> <descriptions> <description descriptionType="Abstract"><p>Simulation input files and source data for the publication: &quot;On the importance of statistics in molecular simulations: thermodynamics, kinetics and simulation box size&quot;.</p></description> </descriptions> <fundingReferences> <fundingReference> <funderName>European Commission</funderName> <funderIdentifier funderIdentifierType="Crossref Funder ID">10.13039/501100000780</funderIdentifier> <awardNumber awardURI="info:eu-repo/grantAgreement/EC/H2020/823830/">823830</awardNumber> <awardTitle>BioExcel-2 Centre of Excellence for Computational Biomolecular Research</awardTitle> </fundingReference> </fundingReferences> </resource>
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