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Molecular Docking of DOX and ADOX to P-gp. (A) Ribbon diagram of P-gp (PDB entry:3G60) complexed with compounds DOX (yellow sticks) and ADOX (green sticks); (B) The proposed docking conformation of compounds DOX (yellow sticks) and ADOX (green sticks) around docking spheres (white spheres) in P-gp; (C) Proposed schematic interactions of DOX with P-gp; (D) Proposed schematic interactions of ADOX with P-gp.
