AgAnt: A computational tool to assess Agonist/Antagonist mode of interaction
Keyword(s):
Activity modulation of proteins is an essential biochemical process in cell. The interplay of the protein, as receptor, and it's corresponding ligand dictates the functional effect. It is imperative to decipher the receptor-ligand functional effect for understanding native biochemical processes as well as for drug discovery. Experimental activity determination is a time extensive process and computational solution towards prediction of activity specific to the receptor-ligand interaction would be of wide interest. We train machine learning models to differentiate between agonist and antagonist protein-ligand pairs and deploy a pairwise approach to utilize the properties of both the receptor and the ligand.
2011 ◽
Vol 11
(15)
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pp. 1978-1993
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2020 ◽
Vol 2
(1)
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pp. 3-6
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2014 ◽
Vol 1
(1)
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pp. 1-5
2018 ◽
Vol 13
(1)
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pp. 21
Keyword(s):
2021 ◽
2019 ◽
Vol 7
(6)
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pp. 985-990
Keyword(s):
2020 ◽
Vol 8
(10)
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pp. 6974-6983
Keyword(s):
2020 ◽