Binding Modes of Three Inhibitors 8CA, F8A and I4A to A-FABP Studied Based on Molecular Dynamics Sim...
Binding Modes of Three Inhibitors 8CA, F8A and I4A to A-FABP Studied Based on Molecular Dynamics Simulation
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United States: Public Library of Science
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Language
English
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United States: Public Library of Science
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Adipocyte fatty-acid binding protein (A-FABP) is an important target of drug designs treating some diseases related to lipid-mediated biology. Molecular dynamics (MD) simulations coupled with solvated interaction energy method (SIE) were carried out to study the binding modes of three inhibitors 8CA, F8A and I4A to A-FABP. The rank of our predicted...
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Full title
Binding Modes of Three Inhibitors 8CA, F8A and I4A to A-FABP Studied Based on Molecular Dynamics Simulation
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TN_cdi_plos_journals_1535002761
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https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_plos_journals_1535002761
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ISSN
1932-6203
E-ISSN
1932-6203
DOI
10.1371/journal.pone.0099862
