A set of ten drug compounds containing an amino group in the structure were determined
theoretically. The parameters were entered into a model to forecast the optimal values of …

The electrochemical of the complexation was applied to evaluate different thermodynamic
parameters ( G, H and S) for the cadmium (II)-tyrosine compound using valtammteric …

Abstract Coronavirus disease (COVID-19) is a global pandemic, first identified in China that
caused the severe acute respiratory syndrome. Currently, there is no specific drug for the …

Computational prediction of the interaction mechanism for ten drugs were applied in this
study. Semi-empirical like (AM1 and PM3), Hartree Fock at basis set [3-21G (d, p), 6-31G (d …

Understanding the mechanisms of action of novel pharmacological candidates is necessary
for the development of new medications, which emphasizes the need of clarifying the …

For the computations of the compounds, the Gaussian 03 software has been applied
utilizing (AM1),(HF), and density functional theory (DFT). Four medications have been …

In late 2019, in Wuhan, China, a new human coronavirus known as severe acute respiratory
syndrome coronavirus 2 (SARS-CoV-2) first appeared. This virus caused the respiratory …

This study examined the docking of two inhibition for SARS-Cov-2 virus (or COVID-19) these
proteins are (6wtt and 6xa4) with nine pharmaceutical compounds (Aminoglutethimide, 4 …

Every day, a large number of individuals die as a result of the devastating disease COVID-
19. Based on molecular docking simulations, the dapsone molecule has been presented as …

Both toremifene (TOR) and tamoxifen (TAM), selective estrogen receptor modulators, are
equally effective therapies for breast cancer (BrCa). In high-risk women, anti-estrogenic …