Pub. Date : 2015 Jan 5
PMID : 25446495
6 Functional Relationships(s)Download |
Sentence | Compound Name | Protein Name | Organism |
| 1 | A combined molecular docking and charge density analysis is a new approach for medicinal research to understand drug-receptor interaction: curcumin-AChE model. | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |
| 2 | In the present study, a molecular docking analysis has been performed on diketone form of curcumin molecule with acetylcholinesterase (AChE). | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |
| 3 | In the present study, a molecular docking analysis has been performed on diketone form of curcumin molecule with acetylcholinesterase (AChE). | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |
| 4 | The calculated lowest docked energy of curcumin molecule in the active site of AChE is -11.21 kcal/mol; this high negative value indicates that the molecule exhibits large binding affinity towards AChE. | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |
| 5 | The calculated lowest docked energy of curcumin molecule in the active site of AChE is -11.21 kcal/mol; this high negative value indicates that the molecule exhibits large binding affinity towards AChE. | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |
| 6 | When the curcumin molecule present in the active site of AChE, subsequently, its conformation has altered significantly and the molecule adopts a U-shape geometry as it is linear in gas phase (before entering into the active site). | Curcumin | acetylcholinesterase (Cartwright blood group) | Homo sapiens |