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GPCR_LigandClassify.py; a rigorous machine learning classifier for GPCR targeting compounds.
Sci Rep. 2021 May 4;11(1):9510. doi: 10.1038/s41598-021-88939-5.
Sci Rep. 2021.
PMID: 33947911
Free PMC article.
A comprehensive structural model for the human KCNQ1/KCNE1 ion channel.
Jalily Hasani H, Ahmed M, Barakat K.
Jalily Hasani H, et al.
J Mol Graph Model. 2017 Nov;78:26-47. doi: 10.1016/j.jmgm.2017.09.019. Epub 2017 Sep 29.
J Mol Graph Model. 2017.
PMID: 28992529
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In Silico Evaluation of Hexamethylene Amiloride Derivatives as Potential Luminal Inhibitors of SARS-CoV-2 E Protein.
Jalily PH, Jalily Hasani H, Fedida D.
Jalily PH, et al. Among authors: jalily hasani h.
Int J Mol Sci. 2022 Sep 13;23(18):10647. doi: 10.3390/ijms231810647.
Int J Mol Sci. 2022.
PMID: 36142556
Free PMC article.
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Effects of protein-protein interactions and ligand binding on the ion permeation in KCNQ1 potassium channel.
Jalily Hasani H, Ganesan A, Ahmed M, Barakat KH.
Jalily Hasani H, et al.
PLoS One. 2018 Feb 14;13(2):e0191905. doi: 10.1371/journal.pone.0191905. eCollection 2018.
PLoS One. 2018.
PMID: 29444113
Free PMC article.
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Modeling the human Nav1.5 sodium channel: structural and mechanistic insights of ion permeation and drug blockade.
Ahmed M, Jalily Hasani H, Ganesan A, Houghton M, Barakat K.
Ahmed M, et al. Among authors: jalily hasani h.
Drug Des Devel Ther. 2017 Aug 4;11:2301-2324. doi: 10.2147/DDDT.S133944. eCollection 2017.
Drug Des Devel Ther. 2017.
PMID: 28831242
Free PMC article.
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