{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,5]],"date-time":"2026-06-05T08:12:29Z","timestamp":1780647149320,"version":"3.54.1"},"reference-count":40,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,5,1]],"date-time":"2026-05-01T00:00:00Z","timestamp":1777593600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Journal of Molecular Graphics and Modelling"],"published-print":{"date-parts":[[2026,5]]},"DOI":"10.1016\/j.jmgm.2026.109281","type":"journal-article","created":{"date-parts":[[2026,1,10]],"date-time":"2026-01-10T16:06:34Z","timestamp":1768061194000},"page":"109281","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":1,"special_numbering":"C","title":["Investigating the effect of membrane pore size on the permeability of carbon nanotubes in reverse electrodialysis using molecular dynamics simulation"],"prefix":"10.1016","volume":"144","author":[{"given":"Zishuo","family":"Zheng","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"N.","family":"Emami","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.jmgm.2026.109281_bib1","doi-asserted-by":"crossref","first-page":"72","DOI":"10.1016\/j.memsci.2014.07.075","article-title":"Mass Transfer in Reverse Electrodialysis: Flow Entrance Effects and Diffusion Boundary Layer Thickness","volume":"471","author":"Pawlowski","year":"2014","journal-title":"J. Membr. Sci."},{"key":"10.1016\/j.jmgm.2026.109281_bib2","first-page":"315","volume":"56","author":"Fubao","year":"1985"},{"key":"10.1016\/j.jmgm.2026.109281_bib3","first-page":"3","volume":"28","author":"Valero","year":"2011"},{"key":"10.1016\/j.jmgm.2026.109281_bib4","doi-asserted-by":"crossref","first-page":"1461","DOI":"10.1007\/s10800-010-0124-8","article-title":"Reverse electrodialysis: evaluation of suitable electrode systems","volume":"40","author":"Veerman","year":"2010","journal-title":"J. Appl. Electrochem"},{"key":"10.1016\/j.jmgm.2026.109281_bib5","series-title":"Sustainable Energy from Salinity Gradients","first-page":"135","article-title":"Reverse electrodialysis: applications","author":"Cipollina","year":"2016"},{"key":"10.1016\/j.jmgm.2026.109281_bib6","first-page":"86","volume":"329","author":"Su","year":"2013","journal-title":"Membrane-free electrodeionization for high purity water production"},{"key":"10.1016\/j.jmgm.2026.109281_bib7","first-page":"90","volume":"144","author":"Hu","year":"2015"},{"issue":"4","key":"10.1016\/j.jmgm.2026.109281_bib8","first-page":"311","article-title":"Single walled and multi walled carbon nanotube structure, synthesis and applications","volume":"2","author":"Ganesh","year":"2013","journal-title":"Int. JInnovative Technol. Explor. Eng."},{"key":"10.1016\/j.jmgm.2026.109281_bib9","first-page":"349","volume":"28","author":"Szendi","year":"2008"},{"key":"10.1016\/j.jmgm.2026.109281_bib10","series-title":"Carbon Nanotubes","author":"Dresselhaus","year":"2000"},{"issue":"55","key":"10.1016\/j.jmgm.2026.109281_bib11","doi-asserted-by":"crossref","first-page":"30703","DOI":"10.1016\/j.ijhydene.2020.08.111","article-title":"Modified single-wall carbon nanotube for reducing fouling in perfluorinated membrane-based reverse electrodialysis","volume":"45","author":"Shah","year":"2020","journal-title":"Int. J. Hydrogen Energy"},{"key":"10.1016\/j.jmgm.2026.109281_bib12","volume":"654","author":"Kim","year":"2022"},{"key":"10.1016\/j.jmgm.2026.109281_bib13","doi-asserted-by":"crossref","first-page":"162","DOI":"10.1016\/j.memsci.2016.05.060","article-title":"Fouling Resistant Nanocomposite Cation Exchange Membrane with Enhanced Power Generation for Reverse Electrodialysis","volume":"516","author":"Tong","year":"2016","journal-title":"J. Membr. Sci."},{"key":"10.1016\/j.jmgm.2026.109281_bib14","volume":"491","author":"Jang","year":"2020"},{"key":"10.1016\/j.jmgm.2026.109281_bib15","volume":"452","author":"Chae","year":"2023"},{"key":"10.1016\/j.jmgm.2026.109281_bib16","volume":"537","author":"Abidin","year":"2022"},{"key":"10.1016\/j.jmgm.2026.109281_bib17","doi-asserted-by":"crossref","first-page":"402","DOI":"10.1016\/j.memsci.2016.10.003","article-title":"The Permselectivity and Water Transference Number of Ion Exchange Membranes in Reverse Electrodialysis","volume":"523","author":"Zlotorowicz","year":"2017","journal-title":"J. Membr. Sci."},{"key":"10.1016\/j.jmgm.2026.109281_bib18","doi-asserted-by":"crossref","first-page":"77","DOI":"10.1016\/j.desal.2013.06.016","article-title":"A review on membrane fabrication: structure, properties and performance relationship","volume":"326","author":"Lalia","year":"2013","journal-title":"Desalination"},{"key":"10.1016\/j.jmgm.2026.109281_bib19","first-page":"621","volume":"541","author":"Kingsbury","year":"2017"},{"key":"10.1016\/j.jmgm.2026.109281_bib20","doi-asserted-by":"crossref","first-page":"107","DOI":"10.1016\/j.memsci.2016.10.035","article-title":"Hybrid Membrane distillation-reverse Electrodialysis Electricity Generation System to Harvest low-grade Thermal Energy","volume":"525","author":"Long","year":"2017","journal-title":"J. Membr. Sci."},{"key":"10.1016\/j.jmgm.2026.109281_bib21","first-page":"71","volume":"486","author":"Hong","year":"2015"},{"issue":"5","key":"10.1016\/j.jmgm.2026.109281_bib22","doi-asserted-by":"crossref","DOI":"10.1002\/qua.70018","article-title":"Exploring graphitic carbon nitride as novel drug delivery system for hesperetin (anticancer drug): insights from dft calculations and molecular dynamics simulations","volume":"125","author":"Ilyas","year":"2025","journal-title":"Int. J. Quant. Chem."},{"issue":"10","key":"10.1016\/j.jmgm.2026.109281_bib23","doi-asserted-by":"crossref","first-page":"6271","DOI":"10.1007\/s11696-022-02298-7","article-title":"Insighting isatin derivatives as potential antiviral agents against NSP3 of COVID-19","volume":"76","author":"Ilyas","year":"2022","journal-title":"Chem. Pap."},{"key":"10.1016\/j.jmgm.2026.109281_bib24","doi-asserted-by":"crossref","DOI":"10.1016\/j.molstruc.2022.132547","article-title":"A DFT approach for finding therapeutic potential of two-dimensional (2D) graphitic carbon nitride (GCN) as a drug delivery carrier for curcumin to treat cardiovascular diseases","volume":"1257","author":"Ilyas","year":"2022","journal-title":"J. Mol. Struct."},{"issue":"33","key":"10.1016\/j.jmgm.2026.109281_bib25","doi-asserted-by":"crossref","first-page":"49490","DOI":"10.1007\/s11356-022-20723-y","article-title":"Microplastic properties and their interaction with hydrophobic organic contaminants: a review","volume":"29","author":"Prajapati","year":"2022","journal-title":"Environ. Sci. Pollut. Control Ser."},{"issue":"6","key":"10.1016\/j.jmgm.2026.109281_bib26","doi-asserted-by":"crossref","DOI":"10.1002\/adts.201900016","article-title":"Structure and transport properties of water and hydrated ions in nanoconfined channels","volume":"2","author":"Zhu","year":"2019","journal-title":"Adv. Theory Simul."},{"key":"10.1016\/j.jmgm.2026.109281_bib27","article-title":"Advanced capacitive deionization for ion selective separation: insights into mechanism over a functional classification","author":"Sun","year":"2023","journal-title":"Chemosphere"},{"issue":"1","key":"10.1016\/j.jmgm.2026.109281_bib28","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1186\/1758-2946-4-17","article-title":"Avogadro: an advanced semantic chemical editor, visualization, and analysis platform","volume":"4","author":"Hanwell","year":"2012","journal-title":"J. Cheminf."},{"issue":"13","key":"10.1016\/j.jmgm.2026.109281_bib29","doi-asserted-by":"crossref","first-page":"2157","DOI":"10.1002\/jcc.21224","article-title":"PACKMOL: a package for building initial configurations for molecular dynamics simulations","volume":"30","author":"Mart\u00ednez","year":"2009","journal-title":"J. Comput. Chem."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109281_bib30","first-page":"98","article-title":"\"Computer\" experiments\" on classical fluids. I","volume":"159","author":"Verlet","year":"1967","journal-title":"Thermodynamical properties of Lennard-Jones molecules"},{"issue":"12","key":"10.1016\/j.jmgm.2026.109281_bib31","first-page":"6991","article-title":"New empirical approach for the structure and energy of covalent systems","volume":"37","author":"Tersoff","year":"1988"},{"key":"10.1016\/j.jmgm.2026.109281_bib32","series-title":"Maxwell's Equations","author":"Huray","year":"2011"},{"issue":"42","key":"10.1016\/j.jmgm.2026.109281_bib34","doi-asserted-by":"crossref","first-page":"25635","DOI":"10.1021\/acs.jpcc.9b05294","article-title":"Water flow in silica nanopores coated by carbon nanotubes from a wetting translucency perspective","volume":"123","author":"Wagemann","year":"2019","journal-title":"J. Phys. Chem. C"},{"issue":"1","key":"10.1016\/j.jmgm.2026.109281_bib35","doi-asserted-by":"crossref","DOI":"10.1038\/srep32262","article-title":"Simulation of water impregnation through vertically aligned CNT forests using a molecular dynamics method","volume":"6","author":"Tajiri","year":"2016","journal-title":"Sci. Rep."},{"issue":"11","key":"10.1016\/j.jmgm.2026.109281_bib36","first-page":"1415","article-title":"The structure of ambient water","volume":"108","author":"Clark","year":"2010"},{"issue":"5","key":"10.1016\/j.jmgm.2026.109281_bib37","doi-asserted-by":"crossref","first-page":"1589","DOI":"10.1021\/cr040426m","article-title":"Molecular dynamics: survey of methods for simulating the activity of proteins","volume":"106","author":"Adcock","year":"2006","journal-title":"Chem. Rev."},{"issue":"39","key":"10.1016\/j.jmgm.2026.109281_bib38","doi-asserted-by":"crossref","DOI":"10.1002\/adfm.201804189","article-title":"On the origin of ion selectivity in ultrathin nanopores: insights for membrane\u2010scale osmotic energy conversion","volume":"28","author":"Cao","year":"2018","journal-title":"Adv. Funct. Mater."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109281_bib39","doi-asserted-by":"crossref","first-page":"4650","DOI":"10.1038\/s41467-021-24947-3","article-title":"Unidirectional ion transport in nanoporous carbon membranes with a hierarchical pore architecture","volume":"12","author":"Chen","year":"2021","journal-title":"Nat. Commun."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109281_bib40","doi-asserted-by":"crossref","first-page":"34","DOI":"10.3390\/ijms24010034","article-title":"Ion and water transport in ion-exchange membranes for power generation systems: guidelines for modeling","volume":"24","author":"Mareev","year":"2022","journal-title":"Int. J. Mol. Sci."},{"issue":"11","key":"10.1016\/j.jmgm.2026.109281_bib41","article-title":"Understanding the giant gap between single-pore and membrane\u2010based nanofluidic osmotic power generators","volume":"15","author":"Gao","year":"2019","journal-title":"Small"}],"container-title":["Journal of Molecular Graphics and Modelling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S1093326326000070?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S1093326326000070?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2026,3,3]],"date-time":"2026-03-03T08:15:57Z","timestamp":1772525757000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S1093326326000070"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,5]]},"references-count":40,"alternative-id":["S1093326326000070"],"URL":"https:\/\/doi.org\/10.1016\/j.jmgm.2026.109281","relation":{},"ISSN":["1093-3263"],"issn-type":[{"value":"1093-3263","type":"print"}],"subject":[],"published":{"date-parts":[[2026,5]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Investigating the effect of membrane pore size on the permeability of carbon nanotubes in reverse electrodialysis using molecular dynamics simulation","name":"articletitle","label":"Article Title"},{"value":"Journal of Molecular Graphics and Modelling","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.jmgm.2026.109281","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2026 Elsevier Inc. All rights are reserved, including those for text and data mining, AI training, and similar technologies.","name":"copyright","label":"Copyright"}],"article-number":"109281"}}