A theoretical insight in interactions of some chemical compounds as mTOR inhibitors
Arthur, David Ebuka, Akoji, Jibrin Noah, Sahnoun, Riadh, Okafor, Greatman C., Abdullahi, Karimatu Lami, Abdullahi, Samira A., Mgbemena, Charles
Published in Bulletin of the National Research Centre (20.03.2021)
Published in Bulletin of the National Research Centre (20.03.2021)
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Journal Article
CO Adsorption on Pd Nanoparticles: Density Functional and Vibrational Spectroscopy Studies
Yudanov, Ilya V., Sahnoun, Riadh, Neyman, Konstantin M., Rösch, Notker, Hoffmann, Jens, Schauermann, Swetlana, Johánek, Viktor, Unterhalt, Holger, Rupprechter, Günther, Libuda, Jörg, Freund, Hans-Joachim
Published in The journal of physical chemistry. B (09.01.2003)
Published in The journal of physical chemistry. B (09.01.2003)
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Journal Article
Development of a new molecular dynamics method for tribochemical reaction and its application to formation dynamics of MoS2 tribofilm
MORITA, Yusuke, ONODERA, Tasuku, DEL CARPIO, Carlos A, SHIN-YOSHI, Takatoshi, NISHINO, Noriaki, SUZUKI, Atsushi, MIYAMOTO, Akira, SUZUKI, Ai, SAHNOUN, Riadh, KOYAMA, Michihisa, TSUBOI, Hideyuki, HATAKEYAMA, Nozomu, ENDOU, Akira, TAKABA, Hiromitsu, KUBO, Momoji
Published in Applied surface science (30.09.2008)
Published in Applied surface science (30.09.2008)
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Conference Proceeding
Journal Article
Study of Carbon Monoxide Oxidation on CeO2(111) Using Ultra Accelerated Quantum Chemical Molecular Dynamics
Alam, Md. Khorshed, Ahmed, Farouq, Nakamura, Katsuyoshi, Suzuki, Ai, Sahnoun, Riadh, Tsuboi, Hideyuki, Koyama, Michihisa, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Del Carpio, Carlos A, Kubo, Momoji, Miyamoto, Akira
Published in Journal of physical chemistry. C (07.05.2009)
Published in Journal of physical chemistry. C (07.05.2009)
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Journal Article
A DFT study on the carbamates formation through the absorption of CO2 by AMP
Ismael, Mohamed, Sahnoun, Riadh, Suzuki, Ai, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Shimizu, Shinkichi, Del Carpio, Carlos A., Miyamoto, Akira
Published in International journal of greenhouse gas control (01.09.2009)
Published in International journal of greenhouse gas control (01.09.2009)
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Journal Article
Development of the overpotential simulator for polymer electrolyte fuel cells and application for optimization of cathode structure
Hattori, Tatsuya, Suzuki, Ai, Sahnoun, Riadh, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Del Carpio, Carlos A., Miyamoto, Akira
Published in Applied surface science (30.09.2008)
Published in Applied surface science (30.09.2008)
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Journal Article
Conference Proceeding
A theoretical investigation on the abrasive wear prevention mechanism of ZDDP and ZP tribofilms
Onodera, Tasuku, Morita, Yusuke, Suzuki, Ai, Sahnoun, Riadh, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Del Carpio, Carlos A., Minfray, Clotilde, Martin, Jean-Michel, Miyamoto, Akira
Published in Applied surface science (30.09.2008)
Published in Applied surface science (30.09.2008)
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Journal Article
Conference Proceeding
Theoretical Study on Electronic and Electrical Properties of Nanostructural ZnO
Zhu, Zhigang, Chutia, Arunabhiram, Sahnoun, Riadh, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Carpio, Carlos A. Del, Miyamoto, Akira
Published in Japanese Journal of Applied Physics (01.04.2008)
Published in Japanese Journal of Applied Physics (01.04.2008)
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Journal Article
Tribochemical reaction dynamics of molybdenum dithiocarbamate on nascent iron surface: a hybrid quantum chemical/classical molecular dynamics study
Onodera, Tasuku, Morita, Yusuke, Suzuki, Ai, Sahnoun, Riadh, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Del Carpio, Carlos A, Deka, Ramesh C, Kubo, Momoji, Miyamoto, Akira
Published in Journal of nanoscience and nanotechnology (01.04.2010)
Published in Journal of nanoscience and nanotechnology (01.04.2010)
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Journal Article
Quantum control of molecular chirality: Ab initio molecular orbital study and wave packet analysis of l,l′-binaphthyl
Hoki, Kunihito, Koseki, Shiro, Matsushita, Takeshi, Sahnoun, Riadh, Fujimura, Yuichi
Published in Journal of photochemistry and photobiology. A, Chemistry. (01.03.2006)
Published in Journal of photochemistry and photobiology. A, Chemistry. (01.03.2006)
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Journal Article
Development of porous structure simulator for multi-scale simulation of irregular porous catalysts
Koyama, Michihisa, Suzuki, Ai, Sahnoun, Riadh, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Del Carpio, Carlos A., Miyamoto, Akira
Published in Applied surface science (30.09.2008)
Published in Applied surface science (30.09.2008)
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Journal Article
Conference Proceeding
Hyperconjugative Electron-Delocalization Mechanism Controlling the Conformational Preference of Fluoroacetaldehyde and Methyl Fluoroacetate
Sahnoun, Riadh, Fujimura, Yuichi, Kabuto, Kuninobu, Takeuchi, Yoshio, Noyori, Ryoji
Published in Bulletin of the Chemical Society of Japan (2006)
Published in Bulletin of the Chemical Society of Japan (2006)
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Journal Article
Development of the reaction time accelerating molecular dynamics method for simulation of chemical reaction
Takaba, Hiromitsu, Hayashi, Shigekazu, Zhong, Huifeng, Malani, Hema, Suzuki, Ai, Sahnoun, Riadh, Koyama, Michihisa, Tsuboi, Hideyuki, Hatakeyama, Nozomu, Endou, Akira, Kubo, Momoji, Del Carrpio, Carlos A., Miyamoto, Akira
Published in Applied surface science (30.09.2008)
Published in Applied surface science (30.09.2008)
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Journal Article
Conference Proceeding
Ultra Accelerated Quantum Chemical Molecular Dynamics Study on Ethylene Polymerization Reaction Using CpSiH2NHTiCl2—Constrained Geometry Catalyst
Malani, Hema, Hayashi, Shigekazu, Suzuki, Ai, Sahnoun, Riadh, Tsuboi, Hideyuki, Koyama, Michihisa, Hatakeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Del Carpio, Carlos A., Miyamoto, Akira
Published in Topics in catalysis (01.06.2009)
Published in Topics in catalysis (01.06.2009)
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Journal Article
Theoretical investigation of ethylene/1-butene copolymerization process using constrained geometry catalyst (CpSiH2NH)-Ti-Cl2
MALANI, Hema, HAYASHI, Shigekazu, DEL CARPIO, Carlos A, MIYAMOTO, Akira, HUIFENG ZHONG, SAHNOUN, Riadh, TSUBOI, Hideyuki, KOYAMA, Michihisa, HATAKEYAMA, Nozomu, ENDOU, Akira, TAKABA, Hiromitsu, KUBO, Momoji
Published in Applied surface science (01.09.2008)
Published in Applied surface science (01.09.2008)
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Conference Proceeding
Journal Article
Time-Dependent Density Functional Theory Investigation of Electric Field Effects on Absorption Spectra of Meso−Meso-Linked Zinc Porphyrin Arrays: Role of Charge-Transfer States
Nakai, Katsunori, Sahnoun, Riadh, Kato, Tsuyoshi, Kono, Hirohiko, Fujimura, Yuichi
Published in The journal of physical chemistry. B (28.07.2005)
Published in The journal of physical chemistry. B (28.07.2005)
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Journal Article
Influence of Organic Functional Groups on the Electrical Properties of Carbon Black: A Theoretical Study
Chutia, Arunabhiram, Zhu, Zhigang, Sahnoun, Riadh, Tsuboi, Hideyuki, Koyama, Michihisa, Hatekeyama, Nozomu, Endou, Akira, Takaba, Hiromitsu, Kubo, Momoji, Carpio, Carlos A. Del, Miyamoto, Akira
Published in Japanese Journal of Applied Physics (01.04.2008)
Published in Japanese Journal of Applied Physics (01.04.2008)
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Journal Article