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QSAR modeling, pharmacophore-based virtual screening, and ensemble docking insights into predicting potential epigallocatechin gallate (EGCG) analogs against epidermal growth factor receptor.
J Recept Signal Transduct Res. 2019 Feb;39(1):18-27. doi: 10.1080/10799893.2018.1564151. Epub 2019 Jun 21.
J Recept Signal Transduct Res. 2019.
PMID: 31223050
Integration of in silico methods to determine endocrine-disrupting tobacco pollutants binding potency with steroidogenic genes: comprehensive QSAR modeling and ensemble docking strategies.
Kumar Konidala K, Bommu U, Pabbaraju N.
Kumar Konidala K, et al.
Environ Sci Pollut Res Int. 2022 Sep;29(43):65806-65825. doi: 10.1007/s11356-022-20443-3. Epub 2022 Apr 30.
Environ Sci Pollut Res Int. 2022.
PMID: 35501431
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Ligand-based virtual screening, molecular docking, QSAR and pharmacophore analysis of quercetin-associated potential novel analogs against epidermal growth factor receptor.
Bommu UD, Konidala KK, Pabbaraju N, Yeguvapalli S.
Bommu UD, et al.
J Recept Signal Transduct Res. 2017 Dec;37(6):600-610. doi: 10.1080/10799893.2017.1377237.
J Recept Signal Transduct Res. 2017.
PMID: 28958213
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Structural Probing, Screening and Structure-Based Drug Repositioning Insights into the Identification of Potential Cox-2 Inhibitors from Selective Coxibs.
Bommu UD, Konidala KK, Pamanji R, Yeguvapalli S.
Bommu UD, et al.
Interdiscip Sci. 2019 Jun;11(2):153-169. doi: 10.1007/s12539-017-0244-5. Epub 2017 Dec 13.
Interdiscip Sci. 2019.
PMID: 29236213
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Computational screening, ensemble docking and pharmacophore analysis of potential gefitinib analogues against epidermal growth factor receptor.
Bommu UD, Konidala KK, Pamanji R, Yeguvapalli S.
Bommu UD, et al.
J Recept Signal Transduct Res. 2018 Feb;38(1):48-60. doi: 10.1080/10799893.2018.1426603.
J Recept Signal Transduct Res. 2018.
PMID: 29369008
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In silico insights into the identification of potential novel angiogenic inhibitors against human VEGFR-2: a new SAR-based hierarchical clustering approach.
Konidala KK, Bommu UD, Pabbaraju N.
Konidala KK, et al. Among authors: bommu ud.
J Recept Signal Transduct Res. 2018 Aug;38(4):372-383. doi: 10.1080/10799893.2018.1531891. Epub 2018 Nov 5.
J Recept Signal Transduct Res. 2018.
PMID: 30396316
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In silico insights into prediction and analysis of potential novel pyrrolopyridine analogs against human MAPKAPK-2: a new SAR-based hierarchical clustering approach.
Konidala KK, Bommu UD, Yeguvapalli S, Pabbaraju N.
Konidala KK, et al. Among authors: bommu ud.
3 Biotech. 2018 Sep;8(9):385. doi: 10.1007/s13205-018-1405-x. Epub 2018 Aug 23.
3 Biotech. 2018.
PMID: 30148035
Free PMC article.
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