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Combinatorial QM and MD in silico design of natural product-based DHFR inhibitors.

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Title: Combinatorial QM and MD in silico design of natural product-based DHFR inhibitors.
Authors: Kalhor, Sepideh1 (AUTHOR), Shapouri, Amin Mohammad1 (AUTHOR), Fattahi, Alireza1 (AUTHOR) fattahi@sharif.edu
Source: Scientific Reports. 10/27/2025, Vol. 15 Issue 1, p1-25. 25p.
Database: Academic Search Ultimate
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  Data: Combinatorial QM and MD in silico design of natural product-based DHFR inhibitors.
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  Data: <searchLink fieldCode="AR" term="%22Kalhor%2C+Sepideh%22">Kalhor, Sepideh</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Shapouri%2C+Amin+Mohammad%22">Shapouri, Amin Mohammad</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Fattahi%2C+Alireza%22">Fattahi, Alireza</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> fattahi@sharif.edu</i>
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  Data: <searchLink fieldCode="JN" term="%22Scientific+Reports%22">Scientific Reports</searchLink>. 10/27/2025, Vol. 15 Issue 1, p1-25. 25p.
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        Value: 10.1038/s41598-025-21262-5
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        Text: English
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