TY - GEN AU - Miller,Bill R AU - Roitberg,Adrian E TI - Design of e-pharmacophore models using compound fragments for the trans-sialidase of Trypanosoma cruzi: screening for novel inhibitor scaffolds SN - 1873-4243 PY - 2014///0527 KW - Antiprotozoal Agents KW - chemistry KW - Binding Sites KW - Drug Design KW - Enzyme Inhibitors KW - Glycoproteins KW - Humans KW - Hydrogen Bonding KW - Models, Molecular KW - Molecular Conformation KW - Molecular Docking Simulation KW - Molecular Dynamics Simulation KW - Molecular Structure KW - Neuraminidase KW - Protein Binding KW - Trypanosoma cruzi KW - enzymology N1 - Publication Type: Journal Article; Research Support, N.I.H., Extramural UR - https://doi.org/10.1016/j.jmgm.2013.08.009 ER -