[图书][B] Methods and algorithms for molecular docking-based drug design and discovery

S Dastmalchi - 2016 - books.google.com
The role of technology in the medical field has resulted in significant developments within
the pharmaceutical industry. Computational approaches have emerged as a crucial method …

[图书][B] Molecular docking for computer-aided drug design: Fundamentals, techniques, resources and applications

MS Coumar - 2021 - books.google.com
Molecular Docking for Computer-Aided Drug Design: Fundamentals, Techniques,
Resources and Applications offers in-depth coverage on the use of molecular docking for …

[图书][B] Applied Case Studies and Solutions in Molecular Docking-Based Drug Design

S Dastmalchi - 2016 - books.google.com
As the pharmaceutical industry continues to advance, new techniques in drug design are
emerging. In order to deliver optimum care to patients, the development of innovative …

Relevance of molecular docking studies in drug designing

R Jakhar, M Dangi, A Khichi… - Current …, 2020 - ingentaconnect.com
Molecular Docking is used to positioning the computer-generated 3D structure of small
ligands into a receptor structure in a variety of orientations, conformations and positions …

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

S Saikia, M Bordoloi - Current drug targets, 2019 - ingentaconnect.com
Molecular docking is a process through which small molecules are docked into the
macromolecular structures for scoring its complementary values at the binding sites. It is a …

[PDF][PDF] Molecular docking: an explanatory approach in structure-based drug designing and discovery

A SHARMA, S KUNWAR, VA VAISHALI, C SINGH… - databases, 2021 - academia.edu
Molecular docking is a modeling tool of Bioinformatics which includes two or more
molecules which interact to provide a stable product in the form of a complex. Molecular …

Molecular docking in modern drug discovery: Principles and recent applications

A Sethi, K Joshi, K Sasikala… - Drug discovery and …, 2019 - books.google.com
The process of hunt of a lead molecule is a long and a tedious process and one is often
demoralized by the endless possibilities one has to search through. Fortunately …

Molecular docking: principles, advances, and its applications in drug discovery

MT Muhammed, E Aki-Yalcin - Letters in Drug Design & …, 2024 - ingentaconnect.com
Molecular docking is a structure-based computational method that generates the binding
pose and affinity between ligands and targets. There are many powerful docking programs …

Molecular docking and structure-based drug design

S Agnihotry, RK Pathak, A Srivastav, PK Shukla… - Computer-aided drug …, 2020 - Springer
Computer-aided drug designing (CADD) relates to drug discovery, also characterized as a
cost-effective and active tool that manages or creates theoretical models that would be used …

[图书][B] Molecular Docking

D Vlachakis - 2018 - books.google.com
Molecular docking has always been and will be on the forefront of developments in the
eminent field of drug design and medicinal chemistry. At the early days, drug discovery was …