Molecular insights into binding of bioactive compounds from essential oil ofTrachyspermum ammiwith human programmed cell death protein 1

The human programmed cell death protein 1 (PD-1) is expressed on the surface of T cells and contributes significantly to tumor immunity. Herein, six major compounds (carvacrol, thymol, β-phellandrene, α-terpinene, myrcene D, and α-pinene) from