Koca, J

Single-coordinate-driving method for molecular docking: application to modeling of guest inclusion in cyclodextrin. [electronic resource] - Journal of molecular graphics & modelling Apr 2000 - 108-18 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

1093-3263

10.1016/S1093-3263(00)00042-5 doi


Carbohydrate Conformation
Computer Simulation
Cyclodextrins--chemistry
Dimethylformamide--chemistry
Hydrogen Bonding
Ligands
Models, Molecular
Propionates--chemistry
Rotation
Software
Thermodynamics