Pub. Date : 2021 Aug 16
PMID : 34396938
1 Functional Relationships(s)Download |
Sentence | Compound Name | Protein Name | Organism |
| 1 | Molecular Dynamic simulations integrated with MM-PBSA calculations have identified In silico potential inhibitors ZINC05135012 and ZINC59378113 against the main protease with -185.171 +- 16.388, -130.759 +- 15.741 kJ/mol respectively, ZINC16638693 and ZINC59378113 against spike protein -141.425 +- 22.447, -129.149 +- 11.449 kJ/mol. | zinc59378113 | surface glycoprotein | Severe acute respiratory syndrome coronavirus 2 |