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In Silico Screening of Chlorogenic Acids from Plant Sources..:
Pravin Kumar Ramalingam
;
Manikandan Chandrasekaran
;
Poonam Gupta
...
doi:10.1021/acsomega.3c07267.s001. , 1753
Link:
https://doi.org/10.1021/acsomega.3c07267.s001
RT Journal T1
In Silico Screening of Chlorogenic Acids from Plant Sources against Human Translocase‑I to Identify Competitive Inhibitors to Treat Diabetes
UL https://suche.suub.uni-bremen.de/peid=base-ftgriffithunifig:oai:figshare.com:article_25108250&Exemplar=1&LAN=DE A1 Pravin Kumar Ramalingam A1 Manikandan Chandrasekaran A1 Poonam Gupta A1 Vinod Nelamangala Umesh A1 Tharun Bharadwaj A1 Naveen Banchallihundi Krishna A1 Roopa Lalitha A1 Gladstone Sigamani Gunaseelan YR 1753 K1 Biophysics K1 Biochemistry K1 Medicine K1 Pharmacology K1 Biotechnology K1 Biological Sciences not elsewhere classified K1 Chemical Sciences not elsewhere classified K1 Information Systems not elsewhere classified K1 top three inhibitors K1 predominant chl source K1 key residues within K1 effective competitive inhibitors K1 devised scoring function K1 conventional docking methods K1 blood sugar levels K1 tricaffeoylquinic acid stood K1 steered molecular dynamics K1 readily available plants K1 study also marks K1 providing valuable insights K1 impaired glucose metabolism K1 identify competitive inhibitors K1 competitive binding results K1 human translocase ‑ K1 various plants K1 valuable tool K1 human translocase K1 gain insights K1 dicaffeoylquinic acid K1 binding dynamics K1 virtual screening K1 thereby inhibiting K1 systematically rank K1 successfully inhibiting K1 structural prerequisites K1 silico screening K1 research contributes K1 rational approach K1 plant sources K1 pioneering effort K1 lead optimization K1 g6 pase K1 drug development K1 drug design K1 docked conformations K1 diminishing reliance K1 consequential reduction K1 competitively bind K1 chlorogenic acids K1 binding pocket JF doi:10.1021/acsomega.3c07267.s001 LK http://dx.doi.org/https://doi.org/10.1021/acsomega.3c07267.s001 DO https://doi.org/10.1021/acsomega.3c07267.s001 SF ELIB - SuUB Bremen
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