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S

Sangwook Wu

department of physics

17H-index
94Paper Count
830Citation Count
Published Papers 35
Publication Date
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Macroscopic joint-based analysis of protein ensembles generated by molecular dynamics simulation
errBiotechnology and Bioprocess Engineering
IF3
err2026-08-14
err0
PREAI
errJayaraman Thangappan; Suhyun Park; Sun-Gu Lee; Sangwook Wu
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Martini 3 Building Blocks for Lipid Nanoparticle Design
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-12-01
err1
PREAI
errKjolbye, Lisbeth R.; Valerio, Mariana; Paloncyova, Marketa; Borges-Araujo, Luis; Pestana-Nobles, Roberto; Grunewald, Fabian; Bruininks, Bart M. H.; Araya-Osorio, Rocio; Srejber, Martin; Mera-Adasme, Raul; Monticelli, Luca; Marrink, Siewert J.; Otyepka, Michal; Wu, Sangwook; Souza, Paulo C. T.
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Integrated cascade biocatalysis of cannabigerolic acid through cyclodextrin-mediated stabilization and prenyltransferase engineering
errBioresource Technology
IF9
err2025-08-25
err0
PREAI
errYe Chan Kim; Hyunseok Yoon; Youngwoo Na; Rohan Ghosh; Seohee Jung; Young Hwan Goh; Sangwoo Joo; Seunho Jung; Boyoung Y. Park; Tae Hyeon Yoo; Suhyun Park; Munikumar Reddy Doddareddy; Sangwook Wu; Hyungdon Yun
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Molecular Dynamics Simulation on the Suppression Mechanism of Phosphorylation to Ser222 by Allosteric Inhibitors Targeting MEK1/2 Kinase
errACS OMEGA
IF4.3
err2024-07-10
err1
errOAAI
errMudedla, Sathish K.; Lee, Hayoung; Kim, Jeom Ji; Jang, Seong Hun; Doddareddy, Munikumar R.; Sanam, Swetha Y.; Gundabathula, Rochish; Park, Jang-June; Wu, Sangwook
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Bartender: Martini 3 Bonded Terms via Quantum Mechanics-Based Molecular Dynamics
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-06-26
err3
errOAAI
errPereira, Gilberto P.; Alessandri, Riccardo; Dominguez, Moises; Araya-Osorio, Rocio; Grunewald, Linus; Borges-Araujo, Luis; Wu, Sangwook; Marrink, Siewert J.; Souza, Paulo C. T.; Mera-Adasme, Raul
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Rational Prediction of PROTAC-Compatible Protein-Protein Interfaces by Molecular Docking
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-10-25
err6
errOAAI
errPereira, Gilberto P.; Jimenez-Garcia, Brian; Pellarin, Riccardo; Launay, Guillaume; Wu, Sangwook; Martin, Juliette; Souza, Paulo C. T.
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Molecular Dynamics Simulation Study of the Selective Inhibition of Coagulation Factor IXa over Factor Xa
errMOLECULES
IF4.6
err2023-10-02
err1
errOAAI
errYoon, Hyun Jung; Kundu, Sibsankar; Wu, Sangwook
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Quantifying Functional-Group-like Structural Fragments in Molecules and Its Applications in Drug Design
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-03-07
err7
PREAI
errMukherjee, Goutam; Braka, Abdennour; Wu, Sangwook
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PCW-A1001, AI-assisted de novo design approach to design a selective inhibitor for FLT-3(D835Y) in acute myeloid leukemia
errFRONTIERS IN MOLECULAR BIOSCIENCES
IF4
err2022-11-25
err3
errOAAI
errJang, Seong Hun; Sivakumar, Dakshinamurthy; Mudedla, Sathish Kumar; Choi, Jaehan; Lee, Sungmin; Jeon, Minjun; Bvs, Suneel Kumar; Hwang, Jinha; Kang, Minsung; Shin, Eun Gyeong; Lee, Kyu Myung; Jung, Kwan-Young; Kim, Jae-Sung; Wu, Sangwook
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Quantum-based machine learning and AI models to generate force field parameters for drug-like small molecules
errFRONTIERS IN MOLECULAR BIOSCIENCES
IF4
err2022-10-11
err7
errOAAI
errMudedla, Sathish Kumar; Braka, Abdennour; Wu, Sangwook
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errSave
Bell-Evans model and steered molecular dynamics in uncovering the dissociation kinetics of ligands targeting G-protein-coupled receptors
errSCIENTIFIC REPORTS
IF3.9
err2022-09-24
err6
errOAAI
errAkhunzada, Muhammad Jan; Yoon, Hyun Jung; Deb, Indrajit; Braka, Abdennour; Wu, Sangwook
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errSave
QM/MM Simulations for the Broken-Symmetry Catalytic Reaction Mechanism of Human Arginase I
errACS OMEGA
IF4.3
err2022-08-30
err0
errOAAI
errMudedla, Sathish Kumar; Ghosh, Boyli; Dhoke, Gaurao, V; Oh, SeKyu; Wu, Sangwook
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errSave
PCW-1001, a Novel Pyrazole Derivative, Exerts Antitumor and Radio-Sensitizing Activities in Breast Cancer
errFRONTIERS IN ONCOLOGY
IF3.3
err2022-03-29
err4
errOAAI
errKang, Minsung; Pandit, Navin; Kim, Ah-Young; Cho, Suk Joon; Kwon, Young-Ju; Ahn, Jiyeon; Lee, Kyu Myung; Wu, Sangwook; Oh, Jeong Su; Jung, Kwan-Young; Kim, Jae-Sung
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A Structure Based Study of Selective Inhibition of Factor IXa over Factor Xa
errMOLECULES
IF4.6
err2021-09-03
err5
errOAAI
errKundu, Sibsankar; Wu, Sangwook
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errSave
Perspectives on High-Throughput Ligand/Protein Docking With Martini MD Simulations
errFRONTIERS IN MOLECULAR BIOSCIENCES
IF4
err2021-03-29
err22
errOAAI
errSouza, Paulo C. T.; Limongelli, Vittorio; Wu, Sangwook; Marrink, Siewert J.; Monticelli, Luca
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errSave
Curvature effects of electron-donating polymers on the device performance of non-fullerene organic solar cells
errJOURNAL OF POWER SOURCES
IF7.9
err2021-01-01
err12
PREAI
errTamilavan, Vellaiappillai; Liu, Yanliang; Shin, Insoo; Agneeswari, Rajalingam; Yang, Hyun-Seock; Kim, Danbi; Kim, Yong Hyun; Wu, Sangwook; Lee, Bo Ram; Park, Sung Heum
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Effect of ligand torsion number on the AutoDock mediated prediction of protein-ligand binding affinity
errJOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY
IF6
err2020-03-01
err27
PREAI
errSriramulu, Dinesh Kumar; Wu, Sangwook; Lee, Sun-Gu
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Lead Acetate Assisted Interface Engineering for Highly Efficient and Stable Perovskite Solar Cells
errACS APPLIED MATERIALS & INTERFACES
IF8.2
err2020-01-16
err18
PREAI
errZhang, Yuanyuan; Ma, Yongchao; Shin, Insoo; Jung, Yun Kyung; Lee, Bo Ram; Wu, Sangwook; Jeong, Jung Hyun; Lee, Byoung Hoon; Kim, Joo Hyun; Kim, Kwang Ho; Park, Sung Heum
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Solution processable small molecules as efficient electron transport layers in organic optoelectronic devices
errJOURNAL OF MATERIALS CHEMISTRY A
IF9.5
err2020-01-01
err19
PREAI
errKim, Jun Tae; Lee, Jihoon; Jang, Soyeong; Yu, Zhongkai; Park, Jong Hyun; Jung, Eui Dae; Lee, Seungjin; Song, Myoung Hoon; Whang, Dong Ryeol; Wu, Sangwook; Park, Sung Heum; Chang, Dong Wook; Lee, Bo Ram
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Eckol as a Potential Therapeutic against Neurodegenerative Diseases Targeting Dopamine D3/D4 Receptors
errMARINE DRUGS
IF5.4
err2019-02-10
err28
errOAAI
errPaudel, Pradeep; Seong, Su Hui; Wu, Sangwook; Park, Suhyun; Jung, Hyun Ah; Choi, Jae Sue
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Research Directions

No research directions
Co-authors
Cooperation Journals
‪
‪Siewert J. Marrink
H-index: 111 · Papers: 737
M
Michal Otyepka
H-index: 85 · Papers: 557
M
Michael Rubinstein
H-index: 85 · Papers: 458
J
Jae Sue Choi
H-index: 72 · Papers: 492
M
Myoung Hoon Song
H-index: 55 · Papers: 179
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