TY - GEN AU - Hernández González,Jorge Enrique AU - Hernández Alvarez,Lilian AU - Pascutti,Pedro Geraldo AU - Leite,Vitor B P TI - Prediction of Noncompetitive Inhibitor Binding Mode Reveals Promising Site for Allosteric Modulation of Falcipain-2 SN - 1520-5207 PY - 2020///0811 KW - Allosteric Regulation KW - drug effects KW - Binding Sites KW - Cysteine Endopeptidases KW - chemistry KW - Cysteine Proteinase Inhibitors KW - pharmacology KW - Enzyme Inhibitors KW - Molecular Docking Simulation KW - Molecular Dynamics Simulation KW - Plasmodium falciparum KW - enzymology KW - Thermodynamics KW - Trypanosoma cruzi N1 - Publication Type: Journal Article; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, Non-P.H.S UR - https://doi.org/10.1021/acs.jpcb.9b05021 ER -