Works matching AU No, Kyoung

Results: 51

Hybrid quantum neural networks with variational quantum regressor for enhancing QSPR modeling of CO<sub>2</sub>-capturing amine.

Published in:

EPJ Quantum Technology, 2025, v. 12, n. 1, p. 1, doi. 10.1140/epjqt/s40507-025-00385-8

By:

Cho, Hyein;
Kim, Jeonghoon;
No, Kyoung Tai;
Lim, Hocheol

Publication type:

Article

Application of the fragment molecular orbital method to discover novel natural products for prion disease.

Published in:

Scientific Reports, 2018, v. 8, n. 1, p. 1, doi. 10.1038/s41598-018-31080-7

By:

Choi, Jiwon;
Kim, Hyo-Jin;
Jin, Xuemei;
Lim, Hocheol;
Kim, Songmi;
Roh, In-Soon;
Kang, Hae-Eun;
No, Kyoung Tai;
Sohn, Hyun-Joo

Publication type:

Article

Development of Natural Compound Molecular Fingerprint (NC-MFP) with the Dictionary of Natural Products (DNP) for natural product-based drug development.

Published in:

Journal of Cheminformatics, 2020, v. 12, n. 1, p. 1, doi. 10.1186/s13321-020-0410-3

By:

Seo, Myungwon;
Shin, Hyun Kil;
Myung, Yoochan;
Hwang, Sungbo;
No, Kyoung Tai

Publication type:

Article

Determination of net atomic charges using a modified partial equalization of orbital electronegativity method. IV. Application to hypervalent sulfur- and phosphorus-containing molecules.

Published in:

Journal of Computational Chemistry, 1995, v. 16, n. 8, p. 1011, doi. 10.1002/jcc.540160808

By:

Park, Je Myung;
Kwon, Oh Young;
No, Kyoung Tai;
Jhon, Mu Shik;
Scheraga, Harold A.

Publication type:

Article

Determination of net atomic charges using a modified partial equalization of orbital electronegativity method. III. Application to halogenated and aromatic molecules.

Published in:

Journal of Computational Chemistry, 1993, v. 14, n. 12, p. 1482, doi. 10.1002/jcc.540141210

By:

Park, Je Myung;
Tai No, Kyoung;
Jhon, Mu Shik;
Scheraga, Harold A.

Publication type:

Article

Development of Drug-Induced Gene Expression Ranking Analysis (DIGERA) and Its Application to Virtual Screening for Poly (ADP-Ribose) Polymerase 1 Inhibitor.

Published in:

International Journal of Molecular Sciences, 2025, v. 26, n. 1, p. 224, doi. 10.3390/ijms26010224

By:

Cho, Hyein;
No, Kyoung Tai;
Lim, Hocheol

Publication type:

Article

Improving gene expression similarity measurement using pathway-based analytic dimension.

Published in:

BMC Genomics, 2009, v. 10, p. 1, doi. 10.1186/1471-2164-10-S3-S15

By:

Changwon Keum;
Jung Hoon Woo;
Won Seok Oh;
Sue-Nie Park;
Kyoung Tai No

Publication type:

Article

PhyloSophos: a high-throughput scientific name mapping algorithm augmented with explicit consideration of taxonomic science, and its application on natural product (NP) occurrence database processing.

Published in:

BMC Bioinformatics, 2023, v. 24, n. 1, p. 1, doi. 10.1186/s12859-023-05588-3

By:

Cho, Min Hyung;
Cho, Kwang-Hwi;
No, Kyoung Tai

Publication type:

Article

Prediction of polyreactive and nonspecific single-chain fragment variables through structural biochemical features and protein language-based descriptors.

Published in:

BMC Bioinformatics, 2022, v. 23, n. 1, p. 1, doi. 10.1186/s12859-022-05010-4

By:

Lim, Hocheol;
No, Kyoung Tai

Publication type:

Article

Effect of the Linking Structure of Nonlinear Optical Side Groups on the Phase Behavior of an Aromatic Polyester Backbone.

Published in:

Macromolecular Theory & Simulations, 2004, v. 13, n. 3, p. 265, doi. 10.1002/mats.200300016

By:

Maeng-Eun Lee;
Seayeal Seong;
Kyoung-Tai No;
O-Pil Kwon;
Suck-Hyun Lee

Publication type:

Article

Quantum computational study of chloride attack on chloromethane for chemical accuracy and quantum noise effects with UCCSD and k-UpCCGSD ansatzes.

Published in:

Scientific Reports, 2022, v. 12, n. 1, p. 1, doi. 10.1038/s41598-022-11537-6

By:

Lim, Hocheol;
Jeon, Hyeon-Nae;
Rhee, June-Koo;
Oh, Byungdu;
No, Kyoung Tai

Publication type:

Article

Structural insight into the antiprion compound inhibition mechanism of native prion folding over misfolding.

Published in:

Chemical Biology & Drug Design, 2017, v. 89, n. 6, p. 907, doi. 10.1111/cbdd.12916

By:

Choi, Jiwon;
Govindaraj, Rajiv Gandhi;
Hyeon, Jae Wook;
Lee, Kyungro;
Ma, SongLing;
Kim, Su Yeon;
Lee, Jeongmin;
No, Kyoung Tai

Publication type:

Article

Novel Scaffold Identification of mGlu1 Receptor Negative Allosteric Modulators Using a Hierarchical Virtual Screening Approach.

Published in:

Chemical Biology & Drug Design, 2016, v. 87, n. 2, p. 239, doi. 10.1111/cbdd.12654

By:

Jang, Jae Wan;
Cho, Nam ‐ Chul;
Min, Sun ‐ Joon;
Cho, Yong Seo;
Park, Ki Duk;
Seo, Seon Hee;
No, Kyoung Tai;
Pae, Ae Nim

Publication type:

Article

Interface-aware molecular generative framework for protein–protein interaction modulators.

Published in:

Journal of Cheminformatics, 2024, v. 16, n. 1, p. 1, doi. 10.1186/s13321-024-00930-0

By:

Wang, Jianmin;
Mao, Jiashun;
Li, Chunyan;
Xiang, Hongxin;
Wang, Xun;
Wang, Shuang;
Wang, Zixu;
Chen, Yangyang;
Li, Yuquan;
No, Kyoung Tai;
Song, Tao;
Zeng, Xiangxiang

Publication type:

Article

TEXTURE DEVELOPMENT AND DRAWABILITY OF FRICTIONALLY ROLLED AA 5052 AL ALLOY SHEET.

Published in:

International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2008, v. 22, n. 31/32, p. 5931, doi. 10.1142/S021797920805139X

By:

KIM, INSOO;
AKRAMOV, SAIDMUROD;
JEONG, HAE BONG;
NO, TAE KYOUNG

Publication type:

Article

Ligand supported homology modeling and docking evaluation of CCR2: docked pose selection by consensus scoring.

Published in:

Journal of Molecular Modeling, 2011, v. 17, n. 10, p. 2707, doi. 10.1007/s00894-010-0943-x

By:

Kim, Jong-Hoon;
Lim, Jee;
Lee, Seung-Woo;
Kim, Kyoungrak;
No, Kyoung

Publication type:

Article

Identification of Novel Rab27a/Melanophilin Blockers by Pharmacophore-Based Virtual Screening.

Published in:

Applied Biochemistry & Biotechnology, 2014, v. 172, n. 4, p. 1882, doi. 10.1007/s12010-013-0615-2

By:

Joung, Jong;
Lee, Ha;
Park, Jongil;
Lee, Jee-Young;
Chang, Byung;
No, Kyoung;
Nam, Ky-Youb;
Hwang, Jae

Publication type:

Article

Discovery of Novel Anti-prion Compounds Using In Silico and In Vitro Approaches.

Published in:

Scientific Reports, 2015, p. 1, doi. 10.1038/srep14944

By:

Jae Wook Hyeon;
Jiwon Choi;
Su Yeon Kim;
Govindaraj, Rajiv Gandhi;
Kyu Jam Hwang;
Yeong Seon Lee;
Seong Soo A. An;
Myung Koo Lee;
Jong Young Joung;
Kyoung Tai No;
Jeongmin Lee

Publication type:

Article

In silico prediction system of CYP450-mediated metabolism profile.

Published in:

2007

By:

Hyesun Han;
Won Seok Oh;
Ji Hoon Jung;
Doo Nam Kim;
Kyoung Tai No

Publication type:

Abstract

Identification of Natural Products as Novel PI3Kβ Inhibitors Through Pharmacophore‐based Virtual Screening.

Published in:

Bulletin of the Korean Chemical Society, 2018, v. 39, n. 3, p. 294, doi. 10.1002/bkcs.11382

By:

Jin, Xuemei;
Kwon, Woosun;
Kim, Tae Soo;
Heo, Jung‐Nyoung;
Chung, Hyun Cheol;
Choi, Jiwon;
No, Kyoung Tai

Publication type:

Article

Comparison of Three-Dimensional Ligand-based Pharmacophores among 11 Phosphodiesterases ( PDE 1 to PDE 11) Pharmacophores.

Published in:

Bulletin of the Korean Chemical Society, 2017, v. 38, n. 9, p. 1033, doi. 10.1002/bkcs.11214

By:

Kim, Sei-Hwan;
Choi, Jiwon;
Lee, Kyungro;
No, Kyoung Tai

Publication type:

Article

Quantitative Structure-Relative Volatility Relationship Model for Extractive Distillation of Ethylbenzene/ p-Xylene Mixtures: Application to Binary and Ternary Mixtures as Extractive Agents.

Published in:

Bulletin of the Korean Chemical Society, 2016, v. 37, n. 4, p. 548, doi. 10.1002/bkcs.10722

By:

Kang, Young-Mook;
Jeon, Yukwon;
Hwang, Sung Bo;
Shin, Hyun Kil;
Oh, Kyunghwan;
Kim, Min Sung;
Kim, Namseok;
You, Hwan;
Son, Hyoungjun;
Chu, Young Hwan;
Cho, Kwang-Hwi;
Shul, Yong-Gun;
No, Kyoung Tai

Publication type:

Article

Comparison of the Wound-Healing Effects of Ginsenosides, their Metabolites, and Aglycones.

Published in:

Bulletin of the Korean Chemical Society, 2016, v. 37, n. 1, p. 52, doi. 10.1002/bkcs.10623

By:

Park, Jun Yeon;
You, Hwan;
Lee, Dahae;
Huh, Wonsang;
Hwang, Gwi Seo;
No, Kyoung Tai;
Kim, Ki Hyun;
Ham, Jungyeob;
Yamabe, Noriko;
Kim, Younghoon;
Kang, Ki Sung

Publication type:

Article

Discovery of FAK Inhibitors Using Structure Based Drug Design.

Published in:

Bulletin of the Korean Chemical Society, 2014, v. 35, n. 11, p. 3156, doi. 10.5012/bkcs.2014.35.11.3156

By:

Ky-Youb Nam;
Dong-Hoon Jin;
Kyoung Tai No;
Soon Kil Ahn

Publication type:

Article

In silico Study on the Interaction between P-glycoprotein and Its Inhibitors at the Drug Binding Pocket.

Published in:

Bulletin of the Korean Chemical Society, 2014, v. 35, n. 8, p. 2317, doi. 10.5012/bkcs.2014.35.8.2317

By:

Namseok Kim;
Jae-Min Shin;
Kyoung Tai No

Publication type:

Article

Identification of Polo-Like Kinase 1 Inhibitors Using Structure-Based Molecular Design.

Published in:

Bulletin of the Korean Chemical Society, 2014, v. 35, n. 7, p. 1929, doi. 10.5012/bkcs.2014.35.7.1929

By:

Ky-Youb Nam;
Ju Hee Kang;
Kyoung Tai No;
Soon Kil Ahn

Publication type:

Article

Toll-like receptor 2 antagonists identified through virtual screening and experimental validation.

Published in:

FEBS Journal, 2017, v. 284, n. 14, p. 2264, doi. 10.1111/febs.14124

By:

Durai, Prasannavenkatesh;
Shin, Hyeon‐Jun;
Achek, Asma;
Kwon, Hyuk‐Kwon;
Govindaraj, Rajiv Gandhi;
Panneerselvam, Suresh;
Yesudhas, Dhanusha;
Choi, Jiwon;
No, Kyoung Tai;
Choi, Sangdun

Publication type:

Article

De novo molecular design with deep molecular generative models for PPI inhibitors.

Published in:

Briefings in Bioinformatics, 2022, v. 23, n. 4, p. 1, doi. 10.1093/bib/bbac285

By:

Wang, Jianmin;
Chu, Yanyi;
Mao, Jiashun;
Jeon, Hyeon-Nae;
Jin, Haiyan;
Zeb, Amir;
Jang, Yuil;
Cho, Kwang-Hwi;
Song, Tao;
No, Kyoung Tai

Publication type:

Article

Hot spot profiles of SARS-CoV-2 and human ACE2 receptor protein protein interaction obtained by density functional tight binding fragment molecular orbital method.

Published in:

Scientific Reports, 2020, v. 10, n. 1, p. N.PAG, doi. 10.1038/s41598-020-73820-8

By:

Lim, Hocheol;
Baek, Ayoung;
Kim, Jongwan;
Kim, Min Sung;
Liu, Jiaxin;
Nam, Ky-Youb;
Yoon, JeongHyeok;
No, Kyoung Tai

Publication type:

Article

Hot Spot Analysis of YAP-TEAD Protein-Protein Interaction Using the Fragment Molecular Orbital Method and Its Application for Inhibitor Discovery.

Published in:

Cancers, 2021, v. 13, n. 16, p. 4246, doi. 10.3390/cancers13164246

By:

Kim, Jongwan;
Lim, Hocheol;
Moon, Sungho;
Cho, Seon Yeon;
Kim, Minhye;
Park, Jae Hyung;
Park, Hyun Woo;
No, Kyoung Tai

Publication type:

Article

Identification of a Small Benzamide Inhibitor of Influenza Virus Using a Cell-Based Screening.

Published in:

Chemotherapy (0009-3157), 2016, v. 61, n. 3, p. 159, doi. 10.1159/000441941

By:

Shin, Woo-Jin;
Nam, Ky-Youb;
Kim, Nam-Doo;
Kim, Sei-Hwan;
No, Kyoung-Tai;
Seong, Baik-Lin

Publication type:

Article

Modeling lipid layers of atopic skin and observation of changes in lipid layer properties with changes in ceramide content.

Published in:

Journal of Cosmetic Dermatology, 2021, v. 20, n. 9, p. 2924, doi. 10.1111/jocd.13861

By:

Jung, In‐Keun;
Choi, Joonho;
Nam, Jin;
No, Kyoung Tai

Publication type:

Article

Small molecule inhibitors of the Dishevelled- CXXC5 interaction are new drug candidates for bone anabolic osteoporosis therapy.

Published in:

EMBO Molecular Medicine, 2016, v. 8, n. 4, p. 375, doi. 10.15252/emmm.201505714

By:

Kim, Hyun‐Yi;
Choi, Sehee;
Yoon, Ji‐Hye;
Lim, Hwan Jung;
Lee, Hyuk;
Choi, Jiwon;
Ro, Eun Ji;
Heo, Jung‐Nyoung;
Lee, Weontae;
No, Kyoung Tai;
Choi, Kang‐Yell

Publication type:

Article

Inhibition of collagenase and melanogenesis by ethanol extracts of Orostachys japonicus A. Berger: possible involvement of Erk and Akt signaling pathways in melanoma cells.

Published in:

Acta Biochimica et Biophysica Sinica, 2017, v. 49, n. 10, p. 945, doi. 10.1093/abbs/gmx090

By:

Dai Sig Im;
Jong-Min Lee;
Jongsung Lee;
Hye Jin Shin;
Kyoung Tai No;
See-Hyoung Park;
Kiyoung Kim

Publication type:

Article

Discovery of a small-molecule inhibitor of Dvl-CXXC5 interaction by computational approaches.

Published in:

Journal of Computer-Aided Molecular Design, 2018, v. 32, n. 5, p. 643, doi. 10.1007/s10822-018-0118-x

By:

Ma, Songling;
Choi, Jiwon;
Jin, Xuemei;
Kim, Hyun-Yi;
Yun, Ji-Hye;
Lee, Weontae;
Choi, Kang-Yell;
No, Kyoung Tai

Publication type:

Article

Discovery of non-peptidic small molecule inhibitors of cyclophilin D as neuroprotective agents in Aβ-induced mitochondrial dysfunction.

Published in:

Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 10, p. 929, doi. 10.1007/s10822-017-0067-9

By:

Park, Insun;
Londhe, Ashwini;
Lim, Ji;
Park, Beoung-Geon;
Jung, Seo;
Lee, Jae;
Lim, Sang;
No, Kyoung;
Lee, Jiyoun;
Pae, Ae

Publication type:

Article

In silico probing and biological evaluation of SETDB1/ESET-targeted novel compounds that reduce tri-methylated histone H3K9 (H3K9me3) level.

Published in:

Journal of Computer-Aided Molecular Design, 2017, v. 31, n. 10, p. 877, doi. 10.1007/s10822-017-0052-3

By:

Park, Insun;
Hwang, Yu;
Kim, TaeHun;
Viswanath, Ambily;
Londhe, Ashwini;
Jung, Seo;
Sim, Kyoung;
Min, Sun-Joon;
Lee, Ji;
Seong, Jihye;
Kim, Yun;
No, Kyoung;
Ryu, Hoon;
Pae, Ae

Publication type:

Article

Pharmacophore-based virtual screening, biological evaluation and binding mode analysis of a novel protease-activated receptor 2 antagonist.

Published in:

Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 8, p. 625, doi. 10.1007/s10822-016-9937-9

By:

Cho, Nam-Chul;
Seo, Seoung-Hwan;
Kim, Dohee;
Shin, Ji-Sun;
Ju, Jeongmin;
Seong, Jihye;
Seo, Seon;
Lee, Iiyoun;
Lee, Kyung-Tae;
Kim, Yun;
No, Kyoung;
Pae, Ae

Publication type:

Article

Comparative QSAR studies on peptide deformylase inhibitors.

Published in:

Journal of Molecular Modeling, 2007, v. 13, n. 5, p. 543

By:

Munikumar Doddareddy;
Yong Cho;
Hyunah Choo;
Hun Koh;
Jae-Hoon Kang;
Kyoung No;
Ae Pae

Publication type:

Article

Investigation of protein-protein interactions and hot spot region between PD-1 and PD-L1 by fragment molecular orbital method.

Published in:

Scientific Reports, 2019, v. 9, n. 1, p. N.PAG, doi. 10.1038/s41598-019-53216-z

By:

Lim, Hocheol;
Chun, Jungho;
Jin, Xuemei;
Kim, Jongwan;
Yoon, JeongHyeok;
No, Kyoung Tai

Publication type:

Article

The efficacy of the food-grade antimicrobial xanthorrhizol against Staphylococcus aureus is associated with McsL channel expression.

Published in:

Frontiers in Microbiology, 2024, p. 1, doi. 10.3389/fmicb.2024.1439009

By:

Mordukhova, Elena A.;
Jongwan Kim;
Haiyan Jin;
Kyoung Tai No;
Jae-Gu Pan

Publication type:

Article

Leveraging the Fragment Molecular Orbital and MM-GBSA Methods in Virtual Screening for the Discovery of Novel Non-Covalent Inhibitors Targeting the TEAD Lipid Binding Pocket.

Published in:

International Journal of Molecular Sciences, 2024, v. 25, n. 10, p. 5358, doi. 10.3390/ijms25105358

By:

Kim, Jongwan;
Jin, Haiyan;
Kim, Jinhyuk;
Cho, Seon Yeon;
Moon, Sungho;
Wang, Jianmin;
Mao, Jiashun;
No, Kyoung Tai

Publication type:

Article

Leveraging the Fragment Molecular Orbital Method to Explore the PLK1 Kinase Binding Site and Polo-Box Domain for Potent Small-Molecule Drug Design.

Published in:

International Journal of Molecular Sciences, 2023, v. 24, n. 21, p. 15639, doi. 10.3390/ijms242115639

By:

Jin, Haiyan;
Kim, Jongwan;
Lee, Onju;
Kim, Hyein;
No, Kyoung Tai

Publication type:

Article

Identification of Novel Natural Product Inhibitors against Matrix Metalloproteinase 9 Using Quantum Mechanical Fragment Molecular Orbital-Based Virtual Screening Methods.

Published in:

International Journal of Molecular Sciences, 2022, v. 23, n. 8, p. 4438, doi. 10.3390/ijms23084438

By:

Lim, Hocheol;
Hong, Hansol;
Hwang, Seonik;
Kim, Song Ja;
Seo, Sung Yum;
No, Kyoung Tai

Publication type:

Article

Bee Venom Activates the Nrf2/HO-1 and TrkB/CREB/BDNF Pathways in Neuronal Cell Responses against Oxidative Stress Induced by Aβ 1–42.

Published in:

International Journal of Molecular Sciences, 2022, v. 23, n. 3, p. 1193, doi. 10.3390/ijms23031193

By:

Nguyen, Cong Duc;
Yoo, Jaehee;
Hwang, Sun-Young;
Cho, Sung-Young;
Kim, Myeonghun;
Jang, Hyemin;
No, Kyoung Ok;
Shin, Jeong Cheol;
Kim, Jae-Hong;
Lee, Gihyun

Publication type:

Article

Tyrosinase-Targeting Gallacetophenone Inhibits Melanogenesis in Melanocytes and Human Skin- Equivalents.

Published in:

International Journal of Molecular Sciences, 2020, v. 21, n. 9, p. 3144, doi. 10.3390/ijms21093144

By:

Lee, Ji Young;
Lee, Jooyun;
Min, Daejin;
Kim, Juewon;
Kim, Hyoung-June;
No, Kyoung Tai

Publication type:

Article

Targeting FLT3-TAZ signaling to suppress drug resistance in blast phase chronic myeloid leukemia.

Published in:

Molecular Cancer, 2023, v. 22, n. 1, p. 1, doi. 10.1186/s12943-023-01837-4

By:

Shin, Ji Eun;
Kim, Soo-Hyun;
Kong, Mingyu;
Kim, Hwa-Ryeon;
Yoon, Sungmin;
Kee, Kyung-Mi;
Kim, Jung Ah;
Kim, Dong Hyeon;
Park, So Yeon;
Park, Jae Hyung;
Kim, Hongtae;
No, Kyoung Tai;
Lee, Han-Woong;
Gee, Heon Yung;
Hong, Seunghee;
Guan, Kun-Liang;
Roe, Jae-Seok;
Lee, Hyunbeom;
Kim, Dong-Wook;
Park, Hyun Woo

Publication type:

Article

Identification and characterization of saikosaponins as antagonists of transient receptor potential A1 channel.

Published in:

2020

By:

Lee, Gyeongbeen;
Choi, Jiwon;
Nam, Yeon‐Ju;
Song, Myung‐Jin;
Kim, Jin Kyu;
Kim, Woo Jung;
Kim, Pansoo;
Lee, Jong Suk;
Kim, Songmi;
No, Kyoung Tai;
Lee, Ji Hyun;
Lee, Jin Koo;
Choi, Yongmun;
Nam, Yeon-Ju;
Song, Myung-Jin

Publication type:

journal article

Assessment of quantitative structure-activity relationship of toxicity prediction models for Korean chemical substance control legislation.

Published in:

Environmental Health & Toxicology, 2015, v. 30, p. 1, doi. 10.5620/eht.s2015007

By:

Kwang-Yon Kim;
Seong Eun Shin;
Kyoung Tai No

Publication type:

Article

Correction: Inhibition of IRP2-dependent reprogramming of iron metabolism suppresses tumor growth in colorectal cancer.

Published in:

2024

By:

Hwang, Jieon;
Park, Areum;
Kim, Chinwoo;
Kim, Chang Gon;
Kwak, Jaesung;
Kim, Byungil;
Shin, Hyunjin;
Ku, Minhee;
Yang, Jaemoon;
Baek, Ayoung;
Choi, Jiwon;
Lim, Hocheol;
No, Kyoung Tai;
Zhao, Xianghua;
Choi, Uyeong;
Kim, Tae Il;
Jeong, Kyu-Sung;
Lee, Hyuk;
Shin, Sang Joon

Publication type:

Correction Notice