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Insight into designing of 2-pyridone derivatives for COVID-19 drug discovery - A computational study.
Struct Chem. 2022 Oct 26:1-20. doi: 10.1007/s11224-022-02076-x. Online ahead of print.
Struct Chem. 2022.
PMID: 36320317
Free PMC article.
Design of novel pyrimidine based remdesivir analogues with dual target specificity for SARS CoV-2: A computational approach.
Dinesh TV, Malgija B, Ponraj MR, Muralakar P, Thathapudi JJ, Kandasamy R, Alagarmalai J, Balakrishnan AB, Ramar PS, James JV, Bhagavathsingh J.
Dinesh TV, et al. Among authors: malgija b.
Int J Biol Macromol. 2023 Jul 1;242(Pt 1):124443. doi: 10.1016/j.ijbiomac.2023.124443. Epub 2023 May 4.
Int J Biol Macromol. 2023.
PMID: 37148943
Free PMC article.
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2-Amino Thiazole Derivatives as Prospective Aurora Kinase Inhibitors against Breast Cancer: QSAR, ADMET Prediction, Molecular Docking, and Molecular Dynamic Simulation Studies.
Bathula S, Sankaranarayanan M, Malgija B, Kaliappan I, Bhandare RR, Shaik AB.
Bathula S, et al. Among authors: malgija b.
ACS Omega. 2023 Nov 7;8(46):44287-44311. doi: 10.1021/acsomega.3c07003. eCollection 2023 Nov 21.
ACS Omega. 2023.
PMID: 38027360
Free PMC article.
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Mutation in MCL1 predicted loop to helix structural transition stabilizes MCL1-Bax binding interaction favoring cancer cell survival.
Deepak Shyl ES, Malgija B, Iniyan AM, Vincent SGP.
Deepak Shyl ES, et al. Among authors: malgija b.
Proteins. 2022 Sep;90(9):1699-1713. doi: 10.1002/prot.26347. Epub 2022 Apr 23.
Proteins. 2022.
PMID: 35429048
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Exploration of Phaeanthine: A Bisbenzylisoquinoline Alkaloid Induces Anticancer Effect in Cervical Cancer Cells Involving Mitochondria-Mediated Apoptosis.
Valsan A, Meenu MT, Murali VP, Malgija B, Joseph AG, Nisha P, Radhakrishnan KV, Maiti KK.
Valsan A, et al. Among authors: malgija b.
ACS Omega. 2023 Apr 10;8(16):14799-14813. doi: 10.1021/acsomega.3c01023. eCollection 2023 Apr 25.
ACS Omega. 2023.
PMID: 37125119
Free PMC article.
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Mining of transcriptome identifies CD109 and LRP12 as possible biomarkers and deregulation mechanism of T cell receptor pathway in Acute Myeloid Leukemia.
Deepak Shyl ES, Malgija B, Iniyan AM, Mahendran R, Prakash Vincent SG.
Deepak Shyl ES, et al. Among authors: malgija b.
Heliyon. 2022 Oct 18;8(10):e11123. doi: 10.1016/j.heliyon.2022.e11123. eCollection 2022 Oct.
Heliyon. 2022.
PMID: 36299526
Free PMC article.
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Collective transcriptomic deregulation of hypertrophic and dilated cardiomyopathy - Importance of fibrotic mechanism in heart failure.
Malgija B, Kumar NS, Piramanayagam S.
Malgija B, et al.
Comput Biol Chem. 2018 Apr;73:85-94. doi: 10.1016/j.compbiolchem.2018.01.011. Epub 2018 Feb 10.
Comput Biol Chem. 2018.
PMID: 29471264
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