An <em>In Silico</em> investigation for acyclovir and its derivatives to fight the COVID-19: Molecular docking, DFT calculations, ADME and td-Molecular dynamics simulations

Publication date: May 2022Source: Journal of the Indian Chemical Society, Volume 99, Issue 5Author(s): Madhur Babu Singh, Pallavi Jain, Jaya Tomar, Vinod Kumar, Indra Bahadur, Dinesh Kumar Arya, Prashant Singh