Relevance of molecular docking studies in drug designing

R Jakhar, M Dangi, A Khichi… - Current …, 2020 - ingentaconnect.com
docking studies by comparisons of the various algorithms [16, 17]. But this review describes
applications and limitations of molecular docking… prediction of the protein-ligand complexes. …

Molecular docking and structure-based drug design strategies

LG Ferreira, RN Dos Santos, G Oliva, AD Andricopulo - Molecules, 2015 - mdpi.com
… The purpose of this review is to examine current molecular docking strategies used in drug
discovery and medicinal chemistry, exploring the advances in the field and the role played by …

[PDF][PDF] Molecular docking: A structure-based drug designing approach

A Tripathi, K Misra - JSM Chem, 2017 - researchgate.net
molecular docking including basic steps of docking, types of interactions, software tools with
their algorithms and applications. Molecular docking … well as in designing effective drugs for …

Molecular docking: challenges, advances and its use in drug discovery perspective

S Saikia, M Bordoloi - Current drug targets, 2019 - ingentaconnect.com
trials and post-marketing surveillance are discussed. These aspects of the molecular drug
designing … review would be an asset to the bioinformatics and drug designing communities. …

Methods for docking and drug designing

AAT Naqvi, MI Hassan - Oncology: Breakthroughs in research and …, 2017 - igi-global.com
… the objective study of small molecule-protein docking in the context of computer-aided drug
design including brief idea of various preceding events of molecular docking such as target …

[PDF][PDF] An overview of molecular docking

S Agarwal, R Mehrotra - JSM chem, 2016 - researchgate.net
… simulations are routinely employed at different stages of the drug discovery and rational drug
designing procedures. As the area of molecular docking-based virtual screening will grow, …

Molecular docking towards drug discovery

DA Gschwend, AC Good… - Journal of Molecular …, 1996 - Wiley Online Library
… The scoring function we seek for drug discovery through molecular docking should
exhibit four distinct qualities: 1) it should be robust over a structurally diverse set of receptor-ligand …

Molecular docking: a powerful approach for structure-based drug discovery

XY Meng, HX Zhang, M Mezei… - … -aided drug design, 2011 - ingentaconnect.com
… tool for drug discovery. In this review, we present a brief introduction of the available molecular
docking methods, and their development and applications in drug discovery. The relevant …

Molecular docking: shifting paradigms in drug discovery

L Pinzi, G Rastelli - International journal of molecular sciences, 2019 - mdpi.com
… applications of docking in drug discovery have heavily changed over the last years. In this
review, we describe how molecular docking was firstly applied to assist in drug discovery tasks…

Drug designing in discovery studio

BL Jejurikar, SH Rohane - 2021 - indianjournals.com
… Studio Software to check the Electrochemical ,Spectroscopic and molecular docking
studies of the insteraction between the anti –retroviral Indinavir andds DNA in this study …