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Journal of Biomolecular Structure and Dynamics Volume 41, 2023 - Issue 17
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Research Articles

In-silico investigations on the anticancer activity of selected 2-aryloxazoline derivatives against breast cancer

Moly Rania Department of Chemistry, Bangladesh University of Engineering and Technology (BUET), Dhaka, Bangladesh
,
Ashutosh Natha Department of Chemistry, Bangladesh University of Engineering and Technology (BUET), Dhaka, Bangladesh;b Department of Chemistry, University of Massachusetts Boston, MA, USACorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0001-8302-0493
ORCID Icon &
Ajoy Kumerc Laboratory of Computational Research for Drug Design and Material Science, Department of Chemistry, European University of Bangladesh, Dhaka, BangladeshORCID Iconhttps://orcid.org/0000-0001-5136-6166
ORCID Icon
Pages 8392-8401 | Received 06 Jul 2022, Accepted 03 Oct 2022, Published online: 16 Oct 2022

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Peilin Pang, Senchen Liu, Xiafei Hao, Yuxin Tian, Shuyue Gong, Dongqiang Miao & Yanjun Zhang. (2023) Exploring binding modes of the selected inhibitors to SND1 by all-atom molecular dynamics simulations. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-15.
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Abirami Arunachalam, Muthumanickam Sankar, Boomi Pandi, Soumi Paul & Sivasudha Thilagar. Evaluation of Rapanone and Nectandrin B as novel inhibitors for targeting the metastatic regulator protein BACH1 using breast cancer cell line Mcf-7. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-16.
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Articles from other publishers (1)

Mahbub Alam, Mohammed Nurul Abser, Ajoy Kumer, Md Mosharef Hossain Bhuiyan, Parul Akter, Md Emdad Hossain & Unesco Chakma. (2023) Synthesis, characterization, antibacterial activity of thiosemicarbazones derivatives and their computational approaches: Quantum calculation, molecular docking, molecular dynamic, ADMET, QSAR. Heliyon 9:6, pages e16222.
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