Scopus by Title (Ref)

Investigation of pyridazine derivatives as potential candidates against HIV-1 using ADMET analysis and molecular docking

Current Chemistry Letters

2026

Sahrane M.

Open Access

DHPMs C5 Amide Bearing Benzothiazole Moiety Inhibit AChE: Design, Synthesis, In Vitro and In Silico Studies

Russian Journal of Bioorganic Chemistry

February 2025

Samiei P.

Molecular Modeling and Drug Design

Computational Methods for Rational Drug Design

1 January 2025

Kesh M.

Computational approaches for designing viral protease inhibitors

Enzymes

2025

Bonardi A.

Simulation analysis reveals catechin from crude Mentha cordifolia has potential antiretroviral properties against HIV and suggests possible protease inhibition through flap and active site interactions

Scienggj

2025

Bungar J.C.

Open Access

Role of integrated bioinformatics in structure-based drug design

Computational Drug Discovery Molecular Simulation for Medicinal Chemistry

7 October 2024

Sahoo B.M.

Computational investigation of Y. aloifolia variegate as anti-Human Immunodeficiency Virus (HIV) targeting HIV-1 protease: A multiscale in-silico exploration

Pharmacological Research Modern Chinese Medicine

June 2024

Irsal R.A.P.

Open Access

Advances in Drug Discovery and Design using Computer-aided Molecular Modeling

Current Computer Aided Drug Design

2024

Singh K.

In Vitro and In Silico Antiviral Activity of Di-Halogenated Compounds Derived from L-Tyrosine against Human Immunodeficiency Virus 1 (HIV-1)

Current Issues in Molecular Biology

October 2023

Serna-Arbeláez M.S.

Open Access

Preparation of Imidodicarbonic diamide Derivatives by Microwave Method Using Layered Double Hydroxides (LDHs), as an Efficient Catalyst and Evaluation of their Anti-HIV Effect: Experimental and Theoretical Studies

Applied Chemistry Today

September 2023

Ghiasifar Z.

Accurate Prediction of Inhibitor Binding to HIV-1 Protease Using CANDOCK

Frontiers in Chemistry

17 January 2022

Falls Z.

Open Access

Ultrahigh Throughput Protein–Ligand Docking with Deep Learning

Methods in Molecular Biology

2022

Clyde A.

The potential of leaf extract of Pangium edule Reinw as HIV-1 protease inhibitor: A computational biology approach

Journal of Applied Pharmaceutical Science

January 2021

Tumilaar S.G.

Open Access

Synthesis of Biuret Derivatives as Potential HIV-1 Protease Inhibitors Using (LDHs-g-HMDI-Citric Acid), as a Green Recyclable Catalyst

Bulletin of the Korean Chemical Society

January 2021

Ghiasifar Z.

Polygonumins A, a newly isolated compound from the stem of Polygonum minus Huds with potential medicinal activities

Scientific Reports

1 December 2018

Ahmad R.

Open Access

Flexibility of important HIV-1 targets and in silico design of anti-HIV drugs

Current Chemical Biology

2018

Martis E.A.F.

Response surface methodology in drug design: A case study on docking analysis of a potent antifungal fluconazole

Computational Biology and Chemistry

1 April 2017

Bohlooli F.