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Insight from Molecular dynamic simulation of reactive oxygen species in oxidized skin membrane

Kumar, Surendra; Yadav, Dharmendra Kumar; Choi, Eun-Ha; Kim, Mi-Hyun

ArticleIssue Date2018CitationSCIENTIFIC REPORTS, v.8PublisherNATURE PUBLISHING GROUP
Molecular Insights into the Interaction of RONS and Thieno[3,2-c]pyran Analogs with SIRT6/COX-2: A Molecular Dynamics Study

Yadav, Dharmendra K.; Kumar, Surendra; Saloni; Misra, Sanjeev; Yadav, Lalit; Teli, Mahesh; Sharma, Praveen; Chaudhary, Sandeep; Kumar, Naresh; Choi, Eun Ha, et al.

ArticleIssue Date2018CitationSCIENTIFIC REPORTS, v.8PublisherNATURE PUBLISHING GROUP
Positioning of an unprecedented spiro[5.5]undeca ring system into kinase inhibitor space

Venkanna, A.; Subedi, L.; Teli, M.K.; Lama, P.D.; Nangunuri, B.G.; Lee, Sang-Yoon; Kim, Sun Yeou; Kim, Mi-hyun

ArticleIssue Date2020CitationScientific Reports, v.10, no.1PublisherNature Research
Identification of novel acetylcholinesterase inhibitors designed by pharmacophore-based virtual screening, molecular docking and bioassay

Jang, Cheongyun; Yadav, Dharmendra K.; Subedi, Lalita; Venkatesan, Ramu; Venkanna, Arramshetti; Afzal, Sualiha; Lee, Eunhee; Yoo, Jaewook; Ji, Eunhee; Kim, Sun Yeou, et al.

ArticleIssue Date2018CitationSCIENTIFIC REPORTS, v.8PublisherNATURE PUBLISHING GROUP
Molecular dynamic simulations of oxidized skin lipid bilayer and permeability of reactive oxygen species

KumarYadav, Dharmendra; Kumar, Surendra; Choi, Eun-Ha; Chaudhary, Sandeep; Kim, Mi-Hyun

ArticleIssue Date2019CitationSCIENTIFIC REPORTS, v.9PublisherNATURE PUBLISHING GROUP
Pharmacological use of a novel scaffold, anomeric N, N-diarylamino tetrahydropyran: molecular similarity search, chemocentric target profiling, and experimental evidence

Venkanna, Arramshetti; Kwon, Oh Wook; Afzal, Sualiha; Jang, Cheongyun; Cho, Kyo Hee; Yadav, Dharmendra K.; Kim, Kang; Park, Hyeung-geun; Chun, Kwang-Hoon; Kim, Sun Yeou, et al.

ArticleIssue Date2017CitationSCIENTIFIC REPORTS, v.7PublisherNATURE PUBLISHING GROUP
Repurposing of FDA approved ring systems through bi-directional target-ring system dual screening

Kumar, S.; Jang, C.; Subedi, L.; Kim, Sun Yeou; Kim, Mi-hyun

ArticleIssue Date2020CitationScientific Reports, v.10, no.1PublisherNature Research
New arylated benzo[h]quinolines induce anti-cancer activity by oxidative stress-mediated DNA damage

Yadav, Dharmendra K.; Rai, Reeta; Kumar, Naresh; Singh, Surjeet; Misra, Sanjeev; Sharma, Praveen; Shaw, Priyanka; Perez-Sanchez, Horacio; Mancera, Ricardo L.; Choi, Eun Ha, et al.

ArticleIssue Date2016CitationSCIENTIFIC REPORTS, v.6PublisherNATURE PUBLISHING GROUP
Prediction of chemical warfare agents based on cholinergic array type meta-predictorsopen access

Kumar, Surendra; Kumar, Chandni; Ahn, Sangjin; Kim, Hyoungrae; Kim, Mi-hyun

ArticleIssue Date2022CitationScientific Reports, v.12, no.1PublisherNATURE PORTFOLIO
Cold atmospheric plasma generated reactive species aided inhibitory effects on human melanoma cells: an in vitro and in silico study

Yadav, Dharmendra Kumar; Adhikari, Manish; Kumar, Surendra; Ghimire, Bhagirath; Han, Ihn; Kim, Mi-Hyun; Choi, Eun-Ha

ArticleIssue Date2020CitationSCIENTIFIC REPORTS, v.10, no.1PublisherNATURE PUBLISHING GROUP
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