Seokmin Shin

发表

Quantum phase transition of water clusters: molecular dynamics simulations with a model potential

Seokmin Shin, W. Son, S. Jang, 2004 .

Replica-exchange method using the generalized effective potential.

Seokmin Shin, S. Jang, Youngshang Pak, 2003, Physical review letters.

Effects of a quantum-mechanically driven two-state gating mode on the diffusion-influenced bimolecular reactions

Sangyoub Lee, Seokmin Shin, Changbong Hyeon, 1997 .

Conformational sampling of metastable states: Tq-REM as a novel replica exchange method.

Seokmin Shin, S. Jang, Jeseong Yoon, 2017, Physical chemistry chemical physics : PCCP.

Conformational Characteristics of Unstructured Peptides: α-Synuclein

Seokmin Shin, S. Jang, Jeseong Yoon, 2008 .

Theoretical investigation of the photoinitiated folding of HP‐36

Seokmin Shin, S. Jang, N. Sreerama, 2006, Protein science : a publication of the Protein Society.

A hybrid modeling strategy using Nuclear Overhauser Effect data with contact information

I. Chu, Jinhyuk Lee, Seokmin Shin, 2012 .

Computational study on the structural diversity of amyloid Beta Peptide (abeta(10-35)) oligomers.

Seokmin Shin, S. Jang, 2008, The journal of physical chemistry. B.

Quantum dynamics of model proton-coupled electron transfer reactions

Seokmin Shin, Sang I. Cho, 2000 .

Dynamics of molecular ion (I2−) in condensed phases: hybrid quantum/classical method for a linear chain model

Seokmin Shin, J. Ka, 1997 .

An interpretation of the multiple fluid-fluid transitions in liquid supported amphiphile monolayers

S. Rice, Seokmin Shin, Zhen‐Ghang Wang, 1990 .

Comment on the mechanism of proton-coupled electron transfer reactions

Seokmin Shin, Sang I. Cho, 2000 .

Synthesis and non-linear optical properties of (alkyne)dicobalt octacarbonyl complexes and their substitution derivatives

In Su Lee, Seokmin Shin, Y. Chung, 2003 .

Wavepacket Correlation Function Approach for Nonadiabatic Reactions: Quasi-Jahn-Teller Model

Seokmin Shin, Heesoo Park, C. Shin, 2014 .

Simulated Q-annealing: conformational search with an effective potential

Seokmin Shin, W. Son, S. Jang, 2011, Journal of Molecular Modeling.

Folding simulations with novel conformational search method.

Seokmin Shin, W. Son, S. Jang, 2007, The Journal of chemical physics.

Designer nanorings with functional cavities from self-assembling β-sheet peptides.

Seokmin Shin, Y. Lim, Myongsoo Lee, 2011, Chemistry, an Asian journal.

Measurement of the ratio of the 3-jet to 2-jet cross sections in pp collisions at s = 7 TeV

V. M. Ghete, M. Z. Mehta, S. M. Etesami, 2011 .

Amyloid beta-peptide oligomerization in silico: dimer and trimer.

Seokmin Shin, S. Jang, 2006, The journal of physical chemistry. B.

Pacific symposium on biocomputing 2011

C. Alkan, F. Hormozdiari, E. Eskin, 2011 .

Dynamics and Entropy of Cyclohexane Rings Control pH-Responsive Reactivity

Seokmin Shin, H. Song, Hyosik Kang, 2021, JACS Au.

Metal-nitrogen intimacy of the nitrogen-doped ruthenium oxide for facilitating electrochemical hydrogen production

Jun Hee Lee, Seokmin Shin, Hyun‐Kon Song, 2021, Applied Catalysis B: Environmental.

Adsorption of 4-Biphenylmethanethiolate on Different-Sized Gold Nanoparticle Surfaces

Seokmin Shin, S. Jang, S. Joo, 2004 .

Computational Studies of Essential Dynamics of Pseudomonas cepacia Lipase

Seokmin Shin, Jinhyuk Lee, Jinhyuk Lee, 2000, Journal of biomolecular structure & dynamics.

Session Introduction

R. Zhou, Xuhui Huang, Seokmin Shin, 2010, PSB.

Laser-assisted ultrafast photoassociation in HeH2+

Seokmin Shin, I. Sola, B. Chang, 2014 .

Ultrafast control of the internuclear distance with parabolic chirped pulses.

Seokmin Shin, I. Sola, B. Chang, 2012, The journal of physical chemistry. A.

Bond breaking in light-induced potentials.

Seokmin Shin, I. Sola, B. Chang, 2009, The Journal of chemical physics.

Oscillating molecular dipoles require strongly correlated electronic and nuclear motion

F. Martín, Seokmin Shin, I. Sola, 2015 .

Relativistic potential energy surfaces of initial oxidations of Si(100) by atomic oxygen: the importance of surface dimer triplet state.

Seokmin Shin, C. Choi, Tae-Rae Kim, 2012, The Journal of chemical physics.

Statistical torsion angle potential energy functions for protein structure modeling: A bicubic interpolation approach

Jinhyuk Lee, Seokmin Shin, J. S. Yang, 2013, Proteins.

Ultrafast coherent control of giant oscillating molecular dipoles in the presence of static electric fields.

F. Martín, Seokmin Shin, I. Sola, 2013, The Journal of chemical physics.

Laser control of the RbCs bond

Seokmin Shin, Yoon Sup Lee, I. Sola, 2017 .

Ultrafast photodissociation assisted by strong non-resonant Stark effect: the ‘straddling’ control pulse

Seokmin Shin, I. Sola, B. Chang, 2009 .

ONE-ELECTRON MODEL FOR PHOTODISSOCIATION DYNAMICS OF DIATOMIC ANION

Seokmin Shin, J. Ka, 1998 .

Conformational Characteristics of

Seokmin Shin, S. Jang, Jeseong Yoon, 2008 .

Efficient chirality transfer in the SmI2-mediated cyclization of aldehydo beta-alkoxyvinyl sulfoxides: asymmetric synthesis of 3-hydroxyoxanes.

Seokmin Shin, Y. Chung, M. Kim, 2007, Organic letters.

Molecular dynamics studies of Langmuir monolayers of F(CF2)11COOH

Stuart A. Rice, Seokmin Shin, S. Rice, 1996 .

Site-dependent effects of methylation on the electronic spectra of jet-cooled methylated xanthine compounds.

Seokmin Shin, Hyung Min Kim, S. K. Kim, 2017, Physical chemistry chemical physics : PCCP.

Comment on the influence of molecular flexibility on molecular packing in Langmuir monolayers

S. Rice, Seokmin Shin, 1994 .

Formation of ordered structure in Langmuir monolayers of semifluorinated hydrocarbons: Molecular dynamics simulations

Seokmin Shin, N. Kim, 1999 .

Remark concerning the theory of the tilting transition in expanded Langmuir monolayers

S. Rice, Seokmin Shin, 1994 .

A molecular dynamics study of the packing structures in monolayers of partially fluorinated amphiphiles

S. Rice, Seokmin Shin, N. Collazo, 1992 .

Multiscale modeling of macromolecular biosystems

Ruhong Zhou, Xuhui Huang, Julie Bernauer, 2012, Briefings Bioinform..

Multiscale modeling of macromolecular

Ruhong Zhou, Xuhui Huang, Julie Bernauer, 2012 .

Mutation effects on FAS1 domain 4 based on structure and solubility

Seokmin Shin, S. Chong, S. Ham, 2021, Biochimica et Biophysica Acta (BBA) - Proteins and Proteomics.

Tuning of the Band Structures of Zigzag Graphene Nanoribbons by an Electric Field and Adsorption of Pyridine and BF3: A DFT Study

Seokmin Shin, J. Lee, Heesoo Park, 2012 .

Geometrical Optimization Approach to Isomerization: Models and Limitations.

Seokmin Shin, I. Sola, B. Chang, 2017, The journal of physical chemistry. A.

Structure and dynamics of I2−(N2O)n: Monte Carlo and molecular dynamics simulations

Seokmin Shin, Eunseog Cho, 2001 .

Tunneling dynamics in a double-well: numerical studies with thermal wavepackets

Seokmin Shin, J. Ka, 2003 .

Structure of 4‐biphenylthiolate on Au nanoparticle surfaces studied by UV‐Vis absorption spectroscopy, transmission electron microscopy and surface‐enhanced Raman scattering

Seokmin Shin, S. Jang, S. Joo, 2004 .

On the numerical solutions of kinetic equations for diffusion-influenced bimolecular reactions

Seokmin Shin, Hyojoon Kim, Kook Joe Shin, 1998 .

The Hydrogen molecular cation as a molecular antenna

Seokmin Shin, I. Sola, B. Chang, 2015 .

Wavepacket correlation function for electronically nonadiabatic reactions

Seokmin Shin, Yeohoon Yoon, C. Shin, 2006 .

Reactive scattering on multiple electronic surfaces: Collinear A+BC-->AB+C reaction

Seokmin Shin, C. Shin, 2000 .

The Two Faces of Peptide Self-Assembly

Seokmin Shin, Jeseong Yoon, MinJun Lee, 2017 .

Computational Study on Oligomer Formation of Fibril-forming Peptide of α-Synuclein

Seokmin Shin, S. Jang, Jeseong Yoon, 2012 .

Graphene Quantum Dots Alleviate Impaired Functions in Niemann-Pick Disease Type C in Vivo.

Dong Jin Kim, B. Hong, Seokmin Shin, 2021, Nano letters.

Site-Specific Backbone and Side-Chain Contributions to Thermodynamic Stabilizing Forces of the WW Domain.

Seokmin Shin, S. Chong, S. Ham, 2021, The journal of physical chemistry. B.

Nonadiabatic effects on the charge transfer rate constant: A numerical study of a simple model system

H. Metiu, Seokmin Shin, 1995 .

Molecular Dynamics Simulation of Benzenethiolate and Benzyl Mercaptide on Au(111)

Seokmin Shin, Kwan Kim, H. Jung, 1999 .

Molecular events in the light of strong fields: A light‐induced potential scenario

Seokmin Shin, I. Sola, B. Chang, 2016 .

Ab initio potential energy surface and rovibrational energies of Ar⋅ ⋅ ⋅CO

Seokmin Shin, F. Tao, S. Shin, 1996 .

Double activation of oxygen intermediates of oxygen reduction reaction by dual inorganic/organic hybrid electrocatalysts

Seokmin Shin, Hyun‐Kon Song, S. Joo, 2021 .

Selectively Enhanced Electrocatalytic Oxygen Evolution within Nanoscopic Channels Fitting a Specific Reaction Intermediate for Seawater Splitting.

Hyun‐Wook Lee, Seokmin Shin, Hyun‐Kon Song, 2022, Small.

Breaking the Linear Scaling Relationship by a Proton Donor for Improving Electrocatalytic Oxygen Reduction Kinetics

Seokmin Shin, Hyun‐Kon Song, S. Joo, 2021, ACS Catalysis.

Two-Dimensional Correlation Analysis of Peptide Unfolding: Molecular Dynamics Simulations of β Hairpins

Seokmin Shin, Jinhyuk Lee, Jinhyuk Lee, 2002 .

Abnormal adsorption behavior of dimethyl disulfide on gold surfaces

Seokmin Shin, S. Jang, S. Joo, 2007 .

Graphene quantum dots prevent α-synucleinopathy in Parkinson’s disease

B. Hong, Seokmin Shin, Misaki Kinoshita, 2017, Nature Nanotechnology.

Folding Dynamics of β-Hairpins: Molecular Dynamics Simulations

Jinhyuk Lee, Seokmin Shin, S. Jang, 2003 .

Quantum reactive scattering: Diabatic approach to the dynamics of chemical reactions

J. Light, Seokmin Shin, 1994 .

Ab initio folding of helix bundle proteins using molecular dynamics simulations.

Soonmin Jang, Seokmin Shin, Seokmin Shin, 2003, Journal of the American Chemical Society.

Molecular Dynamics Study of Peptides in Implicit Water: Ab Initio Folding of β-Hairpin, β-Sheet, and ββα-motif

Soonmin Jang, Seokmin Shin, Seokmin Shin, 2002 .

The role of the acidic domain of α-synuclein in amyloid fibril formation: a molecular dynamics study

Seokmin Shin, S. Jang, Jeseong Yoon, 2016, Journal of biomolecular structure & dynamics.

Tunneling dynamics of amino-acid: model for chiral evolution?

Seokmin Shin, Kyunghee Lee, J. Ka, 2004 .

Computational Insights into the Aggregation Pathway of Self-Assembled Nanotubules.

Seokmin Shin, Jeseong Yoon, Youngbeom Jo, 2021, The journal of physical chemistry. B.

First-Principles Studies on Carbon Nanotubes Functionalized with Azomethine Ylides

Seokmin Shin, Eunseog Cho, Y. Yoon, 2008 .

Molecular‐dynamics studies of the structure and properties of monolayers of perfluorinated amphiphiles

S. Rice, Seokmin Shin, N. Collazo, 1992 .

Comment on molecular dynamics simulations of monolayers of fluorinated amphiphiles

S. Rice, Seokmin Shin, N. Collazo, 1993 .

Selective photodissociation in diatomic molecules by dynamical Stark-shift control.

Seokmin Shin, W. Son, I. Sola, 2008, The Journal of chemical physics.

Spatiotemporal control of entangling gates on atomic N-qubit systems

Seokmin Shin, I. Sola, B. Chang, 2023, 2305.06409.

Finding, mapping, and classifying optimal protocols for two-qubit entangling gates

Seokmin Shin, I. Sola, B. Chang, 2023, Physical Review A.

Bond lengths of diatomic molecules periodically driven by light: the p-LAMB scheme.

Seokmin Shin, I. Sola, B. Chang, 2011, The Journal of chemical physics.

Control defeasance by anti-alignment in the excited state.

F. Martín, Seokmin Shin, I. Sola, 2019, Physical Chemistry, Chemical Physics - PCCP.

Two-pulse control of large-amplitude vibrations in H2(+).

F. Martín, Seokmin Shin, I. Sola, 2013, Chemphyschem : a European journal of chemical physics and physical chemistry.

Further aspects on the control of photodissociation in light-induced potentials.

Seokmin Shin, I. Sola, B. Chang, 2009, The Journal of chemical physics.

Multicanonical ensemble with Nosé–Hoover molecular dynamics simulation

Soonmin Jang, Seokmin Shin, Seokmin Shin, 2002 .

Simulation Studies on the Stabilities of Aggregates Formed by Fibril-Forming Segments of α-Synuclein

Seokmin Shin, S. Jang, Jeseong Yoon, 2009, Journal of biomolecular structure & dynamics.

Structural Properties of Fibril-forming Segments of α-Synuclein

Seokmin Shin, S. Jang, Jeseong Yoon, 2009 .

Dimerization of Fibril-forming Segments of α-Synuclein

Seokmin Shin, S. Jang, Jeseong Yoon, 2009 .

A Molecular Dynamics Study on Controlling the Self-Assembly of β-Sheet Peptides with Designer Nanorings.

Seokmin Shin, SeongByeong Park, Myungsoo Lee, 2015, Chemistry, an Asian journal.

Nonadiabatic dynamics of charge transfer in diatomic anion clusters.

Seokmin Shin, Eunseog Cho, 2007, Journal of Chemical Physics.

Charge transfer and nonadiabatic dynamics of diatomic anions in clusters

Seokmin Shin, Eunseog Cho, 2002 .

Photodissociation Dynamics of Heteronuclear Diatomic Ion (ICl - ) in a Linear-Chain Model

Seokmin Shin, J. Ka, 1998 .

Computational Study on Structure and Aggregation Pathway of Aβ42 Amyloid Protofibril.

Seokmin Shin, Jeseong Yoon, MinJun Lee, 2019, The journal of physical chemistry. B.

Understanding β-Hairpin Formation by Molecular Dynamics Simulations of Unfolding

Jinhyuk Lee, Seokmin Shin, 2001 .

Inter-layer proton transfer with a heterogeneous reaction on ice surface

Seokmin Shin, Yeohoon Yoon, 2008 .

Phase stability and electronic structures of stoichiometric tantalum mononitrides

Seungwu Han, Seokmin Shin, W. Son, 2008 .

A simple method of estimating sampling consistency based on free energy map distance.

Won-Joon Son, Soonmin Jang, Seokmin Shin, 2008, Journal of molecular graphics & modelling.

Copper with an atomic-scale spacing for efficient electrocatalytic co-reduction of carbon dioxide and nitrate to urea

Hyun‐Wook Lee, Seokmin Shin, Tae-Hee Kim, 2023, Energy & Environmental Science.

Effects of surface trapped excess electrons on the dynamics of HCl adsorbed ice surfaces

Seokmin Shin, Yeohoon Yoon, 2007 .

Amyloid β-Peptide Oligomerization in Silico: Dimer and Trimer

Soonmin Jang, Seokmin Shin, Seokmin Shin, 2006 .

DFT Study on Microhydration of [Ni–Cyclam]2+ Complex with R‐COO− Anions#

Seokmin Shin, Heesoo Park, Min-Ah Woo, 2015, Bulletin of the Korean Chemical Society.

Computational Study on Removal of Epoxide from Narrow Zigzag Graphene Nanoribbons

Seokmin Shin, J. Lee, Heesoo Park, 2014 .

Laser adiabatic manipulation of the bond length of diatomic molecules with a single chirped pulse.

Seokmin Shin, I. Sola, B. Chang, 2011, The Journal of chemical physics.

Molecular dynamics studies of semifluorinated hydrocarbon monolayers

Seokmin Shin, N. Kim, 1999 .

The influence of the structure of the surface of a liquid on the properties of a supported monolayer

S. Rice, Seokmin Shin, 1990 .

Monte Carlo simulation study of recombination dynamics in solution

Sangyoub Lee, Seokmin Shin, Hyojoon Kim, 1996 .

Site-dependent effects of methylation on the electronic spectra of jet-cooled methylated xanthine compounds.

Seokmin Shin, Hyung Min Kim, S. K. Kim, 2017, Physical chemistry chemical physics : PCCP.

Bond breaking in light-induced potentials.

Seokmin Shin, I. Sola, B. Chang, 2009, The Journal of chemical physics.

Prediction of helical peptide folding in an implicit water by a new molecular dynamics scheme with generalized effective potential

Seokmin Shin, S. Jang, Youngshang Pak, 2002 .

Ultrafast Population Inversion without the Strong Field Catch: The Parallel Transfer.

Seokmin Shin, I. Sola, B. Chang, 2015, The journal of physical chemistry letters.

Conformational Sampling of Flexible Ligand-binding Protein Loops

Gyu Rie Lee, Chaok Seok, Seokmin Shin, 2012 .

In silico investigation of the structural stability as the origin of the pathogenicity of α-synuclein protofibrils

Seokmin Shin, Jeseong Yoon, MinJun Lee, 2023, Journal of biomolecular structure & dynamics.

A Grid-Based Ehrenfest Model to Study Electron-Nuclear Processes.

Seokmin Shin, I. Sola, B. Chang, 2019, The journal of physical chemistry. A.

Inducing changes in the bond length of diatomic molecules by time-symmetric chirped pulses

Seokmin Shin, B. Chang, 2010 .