Acquired immunodeficiency syndrome (AIDS) is a disease caused by human
immunodeficiency virus (HIV) that affects individuals on all continents. In 1987, the …

Computational chemistry has always played a key role in anti-viral drug development. The
challenges and the quickly rising public interest when a virus is becoming a threat has …

Comparative molecular field analysis (CoMFA) and comparative molecular similarity indices
analysis (CoMSIA) were performed on thiazolidin-4-one class of compounds as HIV-1 …

CoMFA and CoMSIA based 3D-QSAR of HIV-1 RT wild and mutant (K103, Y181C, and
Y188L) inhibitory activities of 4-benzyl/benzoyl pyridin-2-ones followed by protein …

The crystal structures of efavirenz, systematic name:(S)-6-chloro-4-(cyclopropylethynyl)-1, 4-
dihydro-4-(trifluoromethyl)-2H-3, 1-benzoxazin-2-one, C14H9ClF3NO2,(I), a potent and …

Background: Design of inhibitors for HIV-1 reverse transcriptase inhibition (HIV-1 RT) is one
of the successful chemotherapies for the treatment of HIV infection. Among the inhibitors …

Efavirenz,(S)-6-chloro-4 (cyclopropylethynyl)-1, 4-dihydro-4-(trifluoromethyl)-2H-3, 1-
benzoxazin-2-one, is a anti HIV agent belonging to the class of the non-nucleoside inhibitors …

We present a systematic, computational analysis of the electrostatic component of binding of
three HIV‐1 RT inhibitors—nevirapine (NVP), efavirenz (EFV), and the recently approved …

With a wealth of biodiversity, a long tradition of agriculture-based industries, and an
established medical and biotechnological research and development community, Thailand …

The main aim of the present work was to collect and categorize anti-HIV molecules in order
to identify general structure–activity relationships. In this respect, a total of 5580 drugs and …