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Journal of Chemical Information and Modeling
|
October 31, 2024
MOFSynth: A Computational Tool toward Synthetic Likelihood Predictions of MOFs
Charalampos G Livas, Pantelis N Trikalitis, George E Froudakis
Scientific Reports
|
November 9, 2024
Gas adsorption meets geometric deep learning: points, set and match
Antonios P Sarikas, Konstantinos Gkagkas, George E Froudakis
The Journal of Physical Chemistry. B
|
March 24, 2006
Glycine interaction with carbon nanotubes: an ab initio study
Andreas Mavrandonakis, Stavros C Farantos, George E Froudakis
Journal of Nanoscience and Nanotechnology
|
January 30, 2007
A multi scale theoretical study of Li+ interaction with carbon nanotubes
Giannis Mpourmpakis, Emmanuel Tylianakis, Dionisis Papanikolaou, et al.
The Journal of Organic Chemistry
|
May 26, 2001
Stereochemistry in the reaction of 4-methyl-1,2,4-triazoline-3,5-dione (MTAD) with beta,beta dimethyl-p-methoxystyrene. Are open biradicals the reaction intermediates?
M Stratakis, M Hatzimarinaki, G E Froudakis, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
August 15, 2023
Effects of Fluorinated Functionalization of Linker on Quercetin Encapsulation, Release and Hela Cell Cytotoxicity of Cu-Based MOFs as Smart pH-Stimuli Nanocarriers
Mozhgan Parsaei, Kamran Akhbari, Emmanuel Tylianakis, et al.
The Journal of Organic Chemistry
|
March 29, 2003
Ene hydroperoxidation of isobutenylarenes within dye-exchanged zeolite Na-Y: control of site selectivity by cation-arene interactions
Manolis Stratakis, Constantinos Rabalakos, Giannis Mpourmpakis, et al.
Journal of the American Chemical Society
|
September 17, 2009
Enhancement of hydrogen adsorption in metal-organic frameworks by the incorporation of the sulfonate group and Li cations. A multiscale computational study
Andreas Mavrandonakis, Emmanouel Klontzas, Emmanuel Tylianakis, et al.
Nano Letters
|
May 23, 2008
Improving hydrogen storage capacity of MOF by functionalization of the organic linker with lithium atoms
Emmanouel Klontzas, Andreas Mavrandonakis, Emmanuel Tylianakis, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
January 13, 2009
Ab initio study of the interactions between CO(2) and N-containing organic heterocycles
Konstantinos D Vogiatzis, Andreas Mavrandonakis, Wim Klopper, et al.
Page
of 7
Search research articles
Search
Showing results (21-30 of 64) with videos related to
Sort By:
Page
of 7
Journal of Chemical Information and Modeling
|
October 31, 2024
MOFSynth: A Computational Tool toward Synthetic Likelihood Predictions of MOFs
Charalampos G Livas, Pantelis N Trikalitis, George E Froudakis
Scientific Reports
|
November 9, 2024
Gas adsorption meets geometric deep learning: points, set and match
Antonios P Sarikas, Konstantinos Gkagkas, George E Froudakis
The Journal of Physical Chemistry. B
|
March 24, 2006
Glycine interaction with carbon nanotubes: an ab initio study
Andreas Mavrandonakis, Stavros C Farantos, George E Froudakis
Journal of Nanoscience and Nanotechnology
|
January 30, 2007
A multi scale theoretical study of Li+ interaction with carbon nanotubes
Giannis Mpourmpakis, Emmanuel Tylianakis, Dionisis Papanikolaou, et al.
The Journal of Organic Chemistry
|
May 26, 2001
Stereochemistry in the reaction of 4-methyl-1,2,4-triazoline-3,5-dione (MTAD) with beta,beta dimethyl-p-methoxystyrene. Are open biradicals the reaction intermediates?
M Stratakis, M Hatzimarinaki, G E Froudakis, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
August 15, 2023
Effects of Fluorinated Functionalization of Linker on Quercetin Encapsulation, Release and Hela Cell Cytotoxicity of Cu-Based MOFs as Smart pH-Stimuli Nanocarriers
Mozhgan Parsaei, Kamran Akhbari, Emmanuel Tylianakis, et al.
The Journal of Organic Chemistry
|
March 29, 2003
Ene hydroperoxidation of isobutenylarenes within dye-exchanged zeolite Na-Y: control of site selectivity by cation-arene interactions
Manolis Stratakis, Constantinos Rabalakos, Giannis Mpourmpakis, et al.
Journal of the American Chemical Society
|
September 17, 2009
Enhancement of hydrogen adsorption in metal-organic frameworks by the incorporation of the sulfonate group and Li cations. A multiscale computational study
Andreas Mavrandonakis, Emmanouel Klontzas, Emmanuel Tylianakis, et al.
Nano Letters
|
May 23, 2008
Improving hydrogen storage capacity of MOF by functionalization of the organic linker with lithium atoms
Emmanouel Klontzas, Andreas Mavrandonakis, Emmanuel Tylianakis, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
January 13, 2009
Ab initio study of the interactions between CO(2) and N-containing organic heterocycles
Konstantinos D Vogiatzis, Andreas Mavrandonakis, Wim Klopper, et al.
Page
of 7