Hot spot profiles of SARS-CoV-2 and human ACE2 receptor protein protein interaction obtained by density functional tight binding fragment molecular orbital method
Lim, Hocheol, Baek, Ayoung, Kim, Jongwan, Kim, Min Sung, Liu, Jiaxin, Nam, Ky-Youb, Yoon, JeongHyeok, No, Kyoung Tai
Published in Scientific reports (08.10.2020)
Published in Scientific reports (08.10.2020)
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Journal Article
Evidence that phytochrome functions as a protein kinase in plant light signalling
Shin, Ah-Young, Han, Yun-Jeong, Baek, Ayoung, Ahn, Taeho, Kim, Soo Young, Nguyen, Thai Son, Son, Minky, Lee, Keun Woo, Shen, Yu, Song, Pill-Soon, Kim, Jeong-Il
Published in Nature communications (13.05.2016)
Published in Nature communications (13.05.2016)
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Journal Article
Inhibition of IRP2-dependent reprogramming of iron metabolism suppresses tumor growth in colorectal cancer
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
Published in Cell communication and signaling (23.08.2024)
Published in Cell communication and signaling (23.08.2024)
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Journal Article
Discovery of Non-Peptidic Compounds against Chagas Disease Applying Pharmacophore Guided Molecular Modelling Approaches
Rampogu, Shailima, Lee, Gihwan, Baek, Ayoung, Son, Minky, Park, Chanin, Zeb, Amir, Yoon, Sang Hwa, Park, Suhyeon, Lee, Keun Woo
Published in Molecules (Basel, Switzerland) (22.11.2018)
Published in Molecules (Basel, Switzerland) (22.11.2018)
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Journal Article
Ginger (Zingiber officinale) phytochemicals-gingerenone-A and shogaol inhibit SaHPPK: molecular docking, molecular dynamics simulations and in vitro approaches
Rampogu, Shailima, Baek, Ayoung, Gajula, Rajesh Goud, Zeb, Amir, Bavi, Rohit S, Kumar, Raj, Kim, Yongseong, Kwon, Yong Jung, Lee, Keun Woo
Published in Annals of clinical microbiology and antimicrobials (02.04.2018)
Published in Annals of clinical microbiology and antimicrobials (02.04.2018)
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Journal Article
Discovery of Lonafarnib-Like Compounds: Pharmacophore Modeling and Molecular Dynamics Studies
Rampogu, Shailima, Baek, Ayoung, Son, Minky, Park, Chanin, Yoon, Sanghwa, Parate, Shraddha, Lee, Keun Woo
Published in ACS omega (04.02.2020)
Published in ACS omega (04.02.2020)
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Journal Article
Discovery of Potential Plant-Derived Peptide Deformylase (PDF) Inhibitors for Multidrug-Resistant Bacteria Using Computational Studies
Rampogu, Shailima, Zeb, Amir, Baek, Ayoung, Park, Chanin, Son, Minky, Lee, Keun Woo
Published in Journal of clinical medicine (17.12.2018)
Published in Journal of clinical medicine (17.12.2018)
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Journal Article
A Computational Approach with Biological Evaluation: Combinatorial Treatment of Curcumin and Exemestane Synergistically Regulates DDX3 Expression in Cancer Cell Lines
Rampogu, Shailima, Kim, Seong Min, Son, Minky, Baek, Ayoung, Park, Chanin, Lee, Gihwan, Kim, Yumi, Kim, Gon Sup, Kim, Ju Hyun, Lee, Keun Woo
Published in Biomolecules (Basel, Switzerland) (04.06.2020)
Published in Biomolecules (Basel, Switzerland) (04.06.2020)
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Journal Article
Discovery of Small Molecules that Target Vascular Endothelial Growth Factor Receptor-2 Signalling Pathway Employing Molecular Modelling Studies
Rampogu, Shailima, Baek, Ayoung, Park, Chanin, Parate, Shraddha, Parameswaran, Saravanan, Park, Yohan, Shaik, Baji, Kim, Ju Hyun, Park, Seok Ju, Lee, Keun Woo
Published in Cells (Basel, Switzerland) (21.03.2019)
Published in Cells (Basel, Switzerland) (21.03.2019)
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Journal Article
Integration of virtual screening and computational simulation identifies photodynamic therapeutics against human Protoporphyrinogen Oxidase IX (hPPO)
Zeb, Amir, Park, Chanin, Son, Minky, Baek, Ayoung, Cho, Yeongrae, Kim, Donghwan, Rampogu, Shailima, Lee, Gihwan, Kwak, Youn-Sig, Park, Seok Ju, Lee, Keun Woo
Published in Arabian journal of chemistry (01.01.2020)
Published in Arabian journal of chemistry (01.01.2020)
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Journal Article
In Silico Study Probes Potential Inhibitors of Human Dihydrofolate Reductase for Cancer Therapeutics
Rana, Rabia Mukhtar, Rampogu, Shailima, Zeb, Amir, Son, Minky, Park, Chanin, Lee, Gihwan, Yoon, Sanghwa, Baek, Ayoung, Parameswaran, Sarvanan, Park, Seok Ju, Lee, Keun Woo
Published in Journal of clinical medicine (11.02.2019)
Published in Journal of clinical medicine (11.02.2019)
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Journal Article
Pharmacophore Identification for Peroxisome Proliferator-Activated Receptor Gamma Agonists
Sohn, Young-Sik, Lee, Yu-No, Park, Chan-In, Hwang, S-Wan, Kim, Song-Mi, Baek, A-Young, Son, Min-Ky, Suh, Jung-Keun, Kim, Hyong-Ha, Lee, Keun-Woo
Published in Bulletin of the Korean Chemical Society (20.01.2011)
Published in Bulletin of the Korean Chemical Society (20.01.2011)
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Journal Article
Molecular Docking Study of Aminoacyl-tRNA Synthetases with Ligand Molecules from Four Different Scaffolds
Bharatham, Nagakumar, Bharatham, Kavitha, Lee, Yu-No, Kim, Song-Mi, Lazar, Prettina, Baek, A-Young, Park, Chan-In, Eum, Hee-Sung, Ha, Hyun-Joon, Yun, Sae-Young, Lee, Won-Koo, Kim, Sung-Hoon, Lee, Keun-Woo
Published in Bulletin of the Korean Chemical Society (20.03.2010)
Published in Bulletin of the Korean Chemical Society (20.03.2010)
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Journal Article
Natural compounds as potential Hsp90 inhibitors for breast cancer-Pharmacophore guided molecular modelling studies
Rampogu, Shailima, Parate, Shraddha, Parameswaran, Saravanan, Park, Chanin, Baek, Ayoung, Son, Minky, Park, Yohan, Park, Seok Ju, Lee, Keun Woo
Published in Computational biology and chemistry (01.12.2019)
Published in Computational biology and chemistry (01.12.2019)
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Journal Article
Targeting natural compounds against HER2 kinase domain as potential anticancer drugs applying pharmacophore based molecular modelling approaches
Rampogu, Shailima, Son, Minky, Baek, Ayoung, Park, Chanin, Rana, Rabia Mukthar, Zeb, Amir, Parameswaran, Saravanan, Lee, Keun Woo
Published in Computational biology and chemistry (01.06.2018)
Published in Computational biology and chemistry (01.06.2018)
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Journal Article
New compounds identified through in silico approaches reduce the α-synuclein expression by inhibiting prolyl oligopeptidase in vitro
Kumar, Raj, Bavi, Rohit, Jo, Min Gi, Arulalapperumal, Venkatesh, Baek, Ayoung, Rampogu, Shailima, Kim, Myeong Ok, Lee, Keun Woo
Published in Scientific reports (07.09.2017)
Published in Scientific reports (07.09.2017)
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Journal Article