{"headerData":{"lastRefreshDate":"06 Jul 2026"},"publicationOverview":{"publication":{"id":"EF48AED5-622F-4D0A-BF42-55D9956000E9","resourceUrl":"http://gtr.ukri.org/api/publication/overview?outcomeid=5e57a5e2e951c5.39775291&projectref=#grantRef#","outcomeId":"5e57a5e2e951c5.39775291","title":"Biomolecular simulations: From dynamics and mechanisms to computational assays of biological activity","parentPublicationTitle":"WIREs Computational Molecular Science","authors":[{"id":"3d9f884d921660653b0c569b6f52194c","resourceUrl":"http://gtr.ukri.org/api/person/3d9f884d921660653b0c569b6f52194c","firstName":null,"otherNames":"Huggins D","surname":null,"email":null,"orcidId":null,"displayName":"Huggins D","fullName":"Huggins D"}],"date":1514764800000,"digitalPublicationUrl":"http://dx.doi.org/10.1002/wcms.1393","pubMedId":null,"pubMedUrl":null,"isbn":null,"issn":null,"publicationUrl":"http://dx.doi.org/10.1002/wcms.1393","abstractText":null,"volume":null,"issue":"3","totalPages":null,"edition":null,"chapterNumber":null,"chapterTitle":null,"pageRef":null,"series":null,"type":"Journal Article/Review","firstAuthorName":"Huggins D","grantRef":null},"projects":[{"id":"128292D9-3F70-4B38-8E55-6F2ADF72FF47","resourceUrl":"http://gtr.ukri.org/projects?ref=BB/N007700/1","title":"Atomistic and Systems-level Modeling of Phosphate Catalysis","status":null,"grantReference":"BB/N007700/1","grantCategory":"Research Grant","abstractText":null,"potentialImpactText":null,"fund":{"valuePounds":223197,"start":null,"end":null,"funder":{"id":"198E4A3D-B2DC-45D4-8351-7CCEC4061876","resourceUrl":"http://gtr.ukri.org/api/organisation/198E4A3D-B2DC-45D4-8351-7CCEC4061876","name":"BBSRC"},"type":"INCOME_ACTUAL"},"output":null,"publications":null,"identifiers":null,"technicalSummary":null,"projectHierarchy":null,"studentshipHierarchy":null,"healthCategories":[],"researchActivities":[],"researchSubjects":[],"researchTopics":[],"rcukProgrammes":[],"hasClassifications":false}],"abstractSnippet":null}}