I want to conduct a theoretical study in which the antioxidant activity and capacity of a phenolic chemical compound is supposed to be evaluated. The number of atoms of the compound is less than 40. I am absolutely in need of a computational method to use in the molecular modeling. Moreover, for doing the calculation, I need an open-source computational software, preferably a windows version. I thank you in advance for your valuable suggestions.
You can go for Autodock 4 version for docking studies with PDB suitable for antioxidant potentials..Good luck
Thank you vijay. Would you please provide me with more details? Published articles in this domain will be much more beneficial and instructive if offered.
Dr sayed, am very interested about solution to this question and the way forward. Kindly share your findings with me
Dear Fredrick, I will share all my findings in this regard with you. Thank you for your interest.
Article Computational strategies for predicting free radical scaveng...
is an up-to-date review by which it is more likely to find out detailed answers for your queries.Thank you all.
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