Molecular Docking: Principles, Advances, and its Applications in Drug Discovery
Volume 21, Issue 3, January 2024, Pages 480-495
Share article
The New Era of Drug Discovery: The Power of Computer-aided Drug Design (CADD)
Volume 19, Issue 11, November 2022, Pages 951-955
Share article
Aminoalkylated phenolic chalcones: Investigation of biological effects on acetylcholinesterase and carbonic anhydrase I and II as potential lead enzyme inhibitors
Volume 17, Issue 10, January 2020, Pages 1283-1292
Share article
Survey on medicinal plants and herbs in traditional iranian medicine with anti-oxidant, anti-viral, anti-microbial, and anti-inflammation properties
Volume 20, Issue 11, January 2023, Pages 1707-1743
Share article
Phytoestrogens as Potential Antiandrogenic Agents Against Prostate Cancer: An In Silico Analysis
Volume 19, Issue 1, January 2022, Pages 69-78
Share article
In Silico Identification of New Anti-SARS-CoV-2 Agents from Bioactive Phytocompounds Targeting the Viral Spike Glycoprotein and Human TLR4
Volume 19, Issue 3, March 2022, Pages 175-191
Share article
Synthesis and antimicrobial activity of thiohydantoins obtained from L-amino acids
Volume 17, Issue 1, January 2020, Pages 94-102
Share article
Combinatorics, Big Data, Neural Network & AI for Medicinal Chemistry & Drug Administration
Volume 18, Issue 10, October 2021, Pages 943-948
Share article
Molecular docking analysis of flavonoid compounds with matrix metal-loproteinase-8 for the identification of potential effective inhibitors
Volume 18, Issue 1, January 2021, Pages 16-45
Share article
Synthesis, characterization, antimicrobial, anti-tubercular, antioxidant activities and docking simulations of derivatives of 2-(Pyridin-3-yl)-1hbenzo[d]imidazole and 1,3,4-oxadiazole analogy
Volume 17, Issue 8, January 2020, Pages 1047-1059
Share article
Chalcones and bis-chalcones analogs as DPPH and ABTS radical scavengers
Volume 18, Issue 3, January 2021, Pages 249-257
Share article
Antimicrobial activity, antioxidant properties and phytochemical screening of aesculus hippocastanum mother tincture against food-borne bacteria
Volume 17, Issue 1, January 2020, Pages 48-56
Share article
Synthesis, Antimicrobial Activity, and Molecular Modeling Studies of Some Benzoxazole Derivatives
Volume 19, Issue 8, August 2022, Pages 757-768
Share article
Synthesis and Anticancer Activities of Novel Bis-chalcones Incorporating the 1,3-diphenyl-1H-pyrazole Moiety: In Silico and In Vitro Studies
Volume 19, Issue 11, January 2022, Pages 1007-1021
Share article
Design, Synthesis, and In Silico Studies of Novel N-(2-Aminophenyl)-2,3-Diphenylquinoxaline-6-Sulfonamide Derivatives Targeting Receptor-Binding Domain (RBD) of SARS-CoV-2 Spike Glycoprotein and their Evaluation as Antimicrobial and Antimalarial Agents
Volume 18, Issue 9, September 2021, Pages 915-931
Share article
Recent Advances in Drug Design and Delivery Across Biological Barriers Using Computational Models
Volume 19, Issue 10, October 2022, Pages 865-876
Share article
New 2-oxopyridine/2-thiopyridine derivatives tethered to a benzotriazole with cytotoxicity on MCF7 cell lines and with antiviral activities
Volume 17, Issue 2, January 2020, Pages 124-137
Share article
Synthetic Transformation of 4-fluorobenzoic Acid to 4-fluorobenzohydrazide Schiff Bases and 1,3,4-Oxadiazole Analogs having DPPH Radical Scavenging Potential
Volume 20, Issue 12, January 2023, Pages 2018-2024
Share article
Design and Prediction of ADME/Tox Properties of Novel Magnolol Derivatives as Anticancer Agents for NSCLC Using 3D-QSAR, Molecular Dock-ing, MOLCAD and MM-GBSA Studies
Volume 20, Issue 5, January 2023, Pages 545-569
Share article
Repurposing FDA-approved Drugs Targeting SARS-CoV2 3CL<sup>pro</sup>: A Study by Applying Virtual Screening, Molecular Dynamics, MM-PBSA Calculations and Covalent Docking
Volume 19, Issue 7, July 2022, Pages 637-653
Share article
In-silico study to identify dietary molecules as potential sars-cov-2 agents
Volume 18, Issue 6, January 2021, Pages 562-573
Share article
Design, synthesis, and anticancer potential of the enzyme (PARP-1) inhibitor with computational studies of new triazole, thiazolidinone, - thieno [2, 3-d] pyrimidinones
Volume 17, Issue 6, January 2020, Pages 807-825
Share article
The Importance of Salicylic Acid, Humic Acid and Fulvic Acid on Crop Production
Volume 21, Issue 9, January 2024, Pages 1465-1480
Share article
Importance of Thymoquinone, Sulforaphane, Phloretin, and Epigallocatechin and their Health Benefits
Volume 21, Issue 2, January 2024, Pages 209-225
Share article
Synthesis, antiproliferative, and antioxidant activities of substituted n-[(1,3,4-oxadiazol-2-yl) methyl] benzamines
Volume 17, Issue 2, January 2020, Pages 145-154
Share article