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Angewandte Chemie (International Ed. in English)|November 2, 2017
Adsorption-Induced Structural Phase Transformation in NanoporesBogdan Kuchta, Ege Dundar, Filip Formalik, et al.Physical Chemistry Chemical Physics : PCCP|January 9, 2015
Design rules for metal binding biomolecules: understanding of amino acid adsorption on platinum crystallographic facets from density functional calculationsSathish Kumar Ramakrishnan, Marta Martin, Thierry Cloitre, et al.Journal of Colloid and Interface Science|June 9, 2020
Pore opening and breathing transitions in metal-organic frameworks: Coupling adsorption and deformationFilip Formalik, Alexander V Neimark, Justyna Rogacka, et al.Journal of Chemical Information and Modeling|June 18, 2014
Molecular mechanism of selective binding of peptides to silicon surfaceSathish Kumar Ramakrishnan, Marta Martin, Thierry Cloitre, et al.The Journal of Physical Chemistry. A|July 10, 2014
Unique bonding nature of carbon-substituted Be2 dimer inside the carbon (sp(2)) networkRafal Roszak, Szczepan Roszak, D Majumdar, et al.Journal of Molecular Modeling|July 27, 2024
Temperature dependence of the near infrared absorption spectrum of single-wall carbon nanotubes dispersed by sodium dodecyl sulfate in aqueous solution: experiments and molecular dynamics studyCorey Valleroy, Rosa d'Ambrosio, Christophe Blanc, et al.Journal of Molecular Modeling|December 11, 2012
Open carbon frameworks - a search for optimal geometry for hydrogen storageBogdan Kuchta, Lucyna Firlej, Ali Mohammadhosseini, et al.Physical Chemistry Chemical Physics : PCCP|January 29, 2019
Intermediate states approach for adsorption studies in flexible metal-organic frameworksJustyna Rogacka, Filip Formalik, Azahara L Triguero, et al.Journal of Chemical Information and Modeling|March 11, 2020
Self-Assembled Two-Dimensional Nanoporous Crystals as Molecular Sieves: Molecular Dynamics Studies of 1,3,5-Tristyrilbenzene-Cn SuperstructuresAlexander St John, Michael W Roth, Lucyna Firlej, et al.Nanoscale|November 1, 2019
Computer modeling of 2D supramolecular nanoporous monolayers self-assembled on graphiteAlexander St John, Michael W Roth, Lucyna Firlej, et al.Pageof 3