S. Sakai

发表

Ab initio integrated multi-center molecular orbitals method for large cluster systems: total energy and normal vibration.

Shogo Sakai, Shoji Morita, S. Sakai, 2005, The journal of physical chemistry. A.

Theoretical studies on the chemical reaction mechanisms of an aluminum atom with carbon dioxide molecule

S. Sakai, 1992 .

AB INITIO STUDIES ON THE ZIEGLER-NATTA POLYMERIZATION MECHANISMS OF ETHYLENE AND PROPYLENE. ROLE OF COCATALYSIS AND STEREOREGULATION

S. Sakai, 1997 .

Theoretical Study of the Chemical Reactions of B2H6 with Lewis Bases (NH3, PH3, H2O, and H2S)

S. Sakai, 1995 .

Theoretical study on the reaction mechanisms of ethylene with Cp 2 Ti + R, Cp 2 Ti(Cl)R, and Cp 2 Ti(Cl:AlH 2 Cl)R (R=H and CH 3 )

S. Sakai, 2001 .

AB initio study of the structures and vibrational frequencies of CH3SiF3, [CH3SiF4]− and [CH3SiF5]2−

S. Sakai, M. Imoto, 1989 .

Theoretical studies of the radical reaction H2CSiH2 + H

M. Gordon, S. Sakai, 1986 .

Structures and vibrational frequencies of HBeOH, HBOH, HCOH, HMgOH, HAlOH, and HSiOH

K. Jordan, S. Sakai, 1986 .

Theoretical studies of the insertion reactions of atomic carbon and silicon into methane and silane

M. Gordon, S. Sakai, J. Deisz, 1989 .

Involvement of capsaicin-sensitive nerves in the initiation of swallowing evoked by carbonated water in anesthetized rats.

J. Magara, M. Inoue, S. Sakai, 2020, American journal of physiology. Gastrointestinal and liver physiology.

Abnormally narrow carbon-metal-carbon bond angle in M(L1)L2 complexes (M = silicon, aluminum, magnesium, sodium; L1 and L2 = CO, CN)

S. Sakai, S. Inagaki, 1990 .

Theoretical studies on the acetylene-vinylidene rearrangement with a metal atom (Li, Be, B, Na, Mg, and Al)

K. Morokuma, S. Sakai, 1987 .

Another Look at the Mechanism of the Concerted 1,3-Dipolar Cycloaddition of Fulminic Acid to Acetylene.

K. Morokuma, M. Nguyen, S. Sakai, 1999, The Journal of organic chemistry.

Ab initio studies on the electronic structure of the FSO radical

K. Morokuma, S. Sakai, 1980 .

Factors Influencing the Antioxidant Activities of Phenols by an Ab Initio Study

S. Sakai, T. Nishiyama, Shogo Tomiyama, 1993 .

Molecular Orbital Approach to Antioxidant Mechanisms of Phenols by an Ab Initio Study

S. Sakai, T. Nishiyama, Kazunori Tanaka, 1991 .

Synthesis, structure and properties of TTF-carboxylate bridged paddlewheel dirhodium complexes, Rh2(ButCO2)3(TTFCO2) and Rh2(ButCO2)2(TTFCO2)2

T. Kawamura, S. Sakai, M. Ebihara, 2007 .

The Role of Bridging Group of Cyclopentadienyl Ligands for the Ziegler–Natta Catalysis: Theoretical Study

S. Sakai, Y. Kojima, 2009 .

Theoretical studies on the role of bridging group of Cp ligands for the Ziegler–Natta catalysis

S. Sakai, 2007 .

Theoretical studies on the photochemical reaction mechanisms of o-xylylene. Effects of phenyl group for electrocyclic reaction mechanism.

S. Sakai, Toyokazu Yamada, 2008, Physical chemistry chemical physics : PCCP.

Altering the allowed/forbidden gap in cyclobutene electrocyclic reactions: experimental and theoretical evaluations of the effect of planarity constraints.

K. Houk, S. Sakai, Patrick S. Lee, 2003, Journal of the American Chemical Society.

A theoretical investigation of Ziegler-Natta polymerization reaction mechanisms of acetylene

S. Sakai, 1991 .

THEORETICAL STUDIES OF THE MECHANISM OF THE ALUMINATION REACTION OF ETHYLENE AS A ZIEGLER-NATTA-TYPE REACTION MODEL

S. Sakai, 1991 .

Gardneria alkaloids -IX structures of chitosenine and three other minor bases From ? makino

S. Sakai, 1975 .

Driving force of metallo (Mg-H and Mg-Cl)-ene reaction mechanisms.

Tomoyuki Yamada, S. Sakai, T. Udagawa, 2010, Physical chemistry chemical physics : PCCP.

Electronic structures of trithiapentalene analogues

S. Sakai, 2003 .

Molecular and electronic structures of trithiapentalene

S. Sakai, Shin-ya Takane, 1999 .

Theoretical study on the photochemical reactions of butadiene, cyclobutene and bicyclobutane

S. Sakai, 2000 .

Photocyclization paths of butadiene. An ab initio MO study

S. Sakai, 1998 .

Theoretical study on the Cope rearrangement mechanisms and the homoaromaticity of semibullvalene, barbaralane, and 1,5‐methanosemibullvalene

S. Sakai, Yuka Ichikawa, 2012 .

Theoretical studies on the role of bridging group of CGC type ligands for the Ziegler–Natta catalysis

S. Sakai, Y. Kojima, 2009 .

Differential response properties of peripherally and cortically evoked swallows by electrical stimulation in anesthetized rats

Yuki Nakamura, J. Magara, M. Inoue, 2016, Brain Research Bulletin.

Effect of peripherally and cortically evoked swallows on jaw reflex responses in anesthetized rabbits

J. Magara, M. Inoue, S. Sakai, 2018, Brain Research.

Ab initio calculations of the a 3Π–b 3Σ− transition of CH+

K. Morokuma, S. Sakai, S. Kato, 1980 .

Potential energy surfaces of the reaction C++H2 → CH++H

K. Morokuma, S. Sakai, S. Kato, 1981 .

Theoretical studies of the structures and local aromaticity of conjugated polycyclic hydrocarbons using three aromatic indices

S. Sakai, Yuki Kita, 2013 .

THEORETICAL MODEL FOR THE REACTION MECHANISMS OF SINGLET CARBENE ANALOGS INTO UNSATURATED HYDROCARBON AND THE ORIGIN OF THE ACTIVATION BARRIER

S. Sakai, 1998 .

A new mechanism of H2BNH2 formation in the reaction of B2H6 with NH3

S. Sakai, 1994 .

Ab initio study of silylene and dimethylsilylene insertion mechanisms into the silicon-hydrogen bonds of silane and methylsilane

S. Sakai, Masaya Nakamura, 1993 .

Effects of chewing and swallowing behavior on jaw opening reflex responses in freely feeding rabbits

Yuki Nakamura, J. Magara, M. Inoue, 2013, Neuroscience Letters.

Theoretical studies on [2 + 2 + 2] reaction mechanisms of three ethynes. More accurate estimation of activation energy

S. Sakai, S. Kato, T. Udagawa, 2013 .

Theoretical study on the aromaticity of o-, m-, and p-benzyne

S. Sakai, 2005 .

Properties of hyoid muscle contraction during tongue lift measurement.

J. Magara, M. Inoue, S. Sakai, 2020, Journal of oral rehabilitation.

Theoretical Approach to [2+2] Excited Cyclic Reaction between 2-Pyridone and Methylacrylate through Conical Intersections

S. Sakai, Shoko Ito, Mutsumi Yada, 2017 .

Structure prediction and aromaticity of acenes and phenylenes series. A combination method between asymmetric Kekulé structures

S. Sakai, Yuuki Kita, 2012 .

The [2 + 2 + 2] mechanisms of trimerization of three ethynes and monosilaethylenes

S. Sakai, K. Taketa, 2011 .

Theoretical studies on the electrocyclic reaction mechanisms for s- cis butadiene and disilylbutadiene 1 Dedicated to Professor Keiji Morokuma in celebration of his 65th birthday. 1

S. Sakai, 1999 .

Theoretical Studies of Mg(1S, 3P) Atom Reaction Mechanisms with HF, H2O, NH3, HCl, H2S, and PH3 Molecules.

S. Sakai, 1993 .

Central inhibition of initiation of swallowing by systemic administration of diazepam and baclofen in anaesthetized rats.

I. Ujihara, J. Magara, M. Inoue, 2017, American journal of physiology. Gastrointestinal and liver physiology.

Effect of body posture on involuntary swallow in healthy volunteers

Hirokazu Hayashi, J. Magara, M. Inoue, 2016, Physiology & Behavior.

Potential energy surfaces for the reaction silicon + water

M. Gordon, K. Jordan, S. Sakai, 1988 .

Comment on the Electronic Reorganization in 1,3-Dipolar Cycloaddition of Fulminic Acid to Acetylene

M. Nguyen, S. Sakai, T. Uchimaru, 2001 .

Production of hydrogen from reactions of methane with boranes.

M. Nguyen, V. S. Nguyen, S. Sakai, 2009, Physical chemistry chemical physics : PCCP.

Calculations suggest facile hydrogen release from water using boranes and alanes as catalysts

M. Nguyen, V. S. Nguyen, S. Sakai, 2009 .

Mechanism of NO–CO reaction over highly dispersed cuprous oxide on γ-alumina catalyst using a metal–support interfacial site in the presence of oxygen: similarities to and differences from biological systems

S. Sakaki, M. Ehara, Tsunehiro Tanaka, 2018 .

Theoretical Studies of the Electrocyclic Reaction Mechanisms of Hexatriene to Cyclohexadiene

S. Sakai, Shin-ya Takane, 1999 .

Theoretical simple estimation and accurate evaluation of local aromaticity for polycyclic conjugated hydrocarbons

S. Sakai, 2014 .

Estimation of the Distribution of Excited [2 + 2] Cyclic Reaction Paths through Conical Intersection by CiLC Analysis

S. Sakai, Keita Nakamura, Shoko Ito, 2014 .

Criteria for pericyclic and pseudopericyclic character of electrocyclization of (Z)-1,2,4,6-heptatetraene and (2Z)-2,4,5-hexatriene-1-imine

S. Sakai, 2008 .

Theoretical analysis of concerted and stepwise mechanisms of the hetero-Diels-Alder reaction of butadiene with formaldehyde and thioformaldehyde

S. Sakai, 2003 .

Theoretical analysis of the Cope rearrangement of 1,5-hexadiene and phenyl derivatives

Shogo Sakai, S. Sakai, 2002 .

Theoretical Studies on the Validity of B3LYP Density Functional Theory for Symmetrical Electrocyclic Reactions

BioChem Press, S. Sakai, 2002 .

Theoretical analysis of cyclic reaction mechanisms of two ethylenes

S. Sakai, 2002 .

Theoretical analysis of the Cope rearrangement of 1,5-hexadiene

S. Sakai, 2000 .

Theoretical studies on the substituent effects for concerted and stepwise mechanisms of the Diels–Alder reaction between butadiene and ethylene

S. Sakai, T. Okumura, 2004 .

Theoretical Analysis of Concerted and Stepwise Mechanisms of Diels−Alder Reaction between Butadiene and Ethylene

S. Sakai, 2000 .

New Criterion on the Aromaticity of Six-Membered Rings

S. Sakai, 2002 .

Theoretical study on molecular electronic devices. I: Assessment of switching by hydrogen transfer for pyrazole model

S. Sakai, 1995 .

Ab initio molecular dynamics of protonated water clusters by integrated multicenter molecular‐orbital method

Shogo Sakai, Taro Udagawa, S. Sakai, 2011, J. Comput. Chem..

Possible gas-phase ion pairs in amine-HCl complexes. An ab initio theoretical study

K. Morokuma, S. Sakai, Z. Latajka, 1984 .

Theoretical determination of the electronic mechanisms of 1,3-dipolar cycloaddition reactions of fulminic acid and diazomethane

M. Nguyen, S. Sakai, 2004 .

Orbital Phase Control of Trigonal Pyramidal Structures of Tricoordinated Metal Complexes

S. Sakai, S. Inagaki, K. Iwase, 1994 .

Gardneria alkaloids II. The structures of gardnerine, gardnutine and hydroxygardnutine.

S. Sakai, A. Kubo, J. Haginiwa, 1969, Tetrahedron letters.

Electronic structure of the mixed aluminum and sodium cluster Al2Na

M. Nguyen, Ling Lin, S. Sakai, 2009 .

IMiCMO: a new integrated ab initio multicenter molecular orbitals method for molecular dynamics calculations in solvent cluster systems

Shogo Sakai, Shoji Morita, S. Sakai, 2001, J. Comput. Chem..

Theoretical Studies of the Electrocyclic Reaction Mechanisms of o-Xylylene to Benzocyclobutene

S. Sakai, 2000 .

Changes in the frequency of swallowing during electrical stimulation of superior laryngeal nerve in rats

Yuki Nakamura, J. Magara, M. Inoue, 2015, Brain Research Bulletin.

Effects of chewing and swallowing behavior on jaw opening reflex responses in freely feeding rabbits

Yuki Nakamura, J. Magara, M. Inoue, 2013, Neuroscience Letters.

Modulation of Oral Sensation during Electrical Stimulation of the Superior Laryngeal Nerve

J. Magara, M. Inoue, S. Sakai, 2015 .

The Mechanism of the Jaw Reflex Modulation during Swallowing

J. Magara, M. Inoue, S. Sakai, 2014 .

Exploring Passive Exoskeleton-Induced Changes in Lumbar Muscle Activity

S. Sakai, R. Fujitani, T. Jiroumaru, 2023, Open Journal of Therapy and Rehabilitation.