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1 . Academic Journal
Accurate Absorption Energy Calculations in Solution Using the Reference Interaction Site Model Self-Consistent Field Including the Constrained Spatial Electron Density Distribution
저자
by
Daisuke Yokogawa
.
소스
J, Vol 4, Iss 4, Pp 638-644 (2021)
Open Access (DOAJ)
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3 . Academic Journal
Modular synthesis of α-fluorinated arylmethanes via desulfonylative cross-coupling
저자
by
Masakazu Nambo
;
Jacky C.-H. Yim
;
Luiza B. O. Freitas
;
Yasuyo Tahara
;
Zachary T. Ariki
, et al.
소스
Nature Communications, Vol 10, Iss 1, Pp 1-7 (2019)
Open Access (DOAJ)
Web of Science
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7 . Academic Journal
溶液内化学現象の理解を目指した理論研究
저자
by
Daisuke YOKOGAWA
;
横川 大輔
.
소스
化学と教育 / CHEMISTRY & EDUCATION. 2019, 67(5):216
Open Access (JSTAGE)
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4 . Academic Journal
3PT178 Conformational properties of the Def6 PH domain located at the lipid bilayer surface(The 50th Annual Meeting of the Biophysical Society of Japan)
저자
by
Daisuke Yokogawa
;
Katsuyuki Nishimura
;
Michikazu Tanio
;
Naomi Tokuda
;
Satoru Tuzi
, et al.
소스
Seibutsu Butsuri. 2012, 52(supplement):172
Open Access (JSTAGE)
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7 . Academic Journal
A hybrid framework of first principles molecular orbital calculations and a three-dimensional integral equation theory for molecular liquids: Multi-center molecular Ornstein-Zernike self-consistent field approach.
저자
by
Kentaro Kido
;
Kento Kasahara
;
Daisuke Yokogawa
;
Hirofumi Sato
.
소스
Journal of Chemical Physics
. 2015, Vol. 143 Issue 1, p1-9. 9p. 3 Diagrams, 4 Charts, 4 Graphs.
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6 .
Theoretical Understanding of the Nonlinear Raman Shift of C≡N Stretching Vibration of p-Aminobenzonitrile in Supercritical Water
저자
by
Kayo Suda
;
Daisuke Yokogawa
.
소스
The Journal of Physical Chemistry B
. 127:3010-3015
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4 .
Spin–Orbit Coupling Calculation Combined with the Reference Interaction Site Model Self-Consistent Field Explicitly Including Constrained Spatial Electron Density Distribution
저자
by
Kayo Suda
;
Daisuke Yokogawa
.
소스
Journal of Chemical Theory and Computation
. 18:6043-6051
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4 .
Interpretable attribution assignment for octanol-water partition coefficient
저자
by
Daisuke Yokogawa
;
Kayo Suda
.
소스
Open Access (OpenAIRE)
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4 . Academic Journal
Isotropic Site-Site Dispersion Potential Determined from Localized Frequency-Dependent Density Susceptibility.
저자
by
Daisuke Yokogawa
.
소스
Bulletin of the Chemical Society of Japan; Oct2019, Vol. 92 Issue 10, p1694-1700, 7p
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3 . Academic Journal
Isotropic Site-Site Dispersion Potential Constructed Using Quantum Chemical Calculations and a Geminal Auxiliary Basis Set.
저자
by
Daisuke Yokogawa
.
소스
Bulletin of the Chemical Society of Japan; Apr2019, Vol. 92 Issue 4, p748-753, 6p
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