Computational approaches in drug discovery and design

RK Pathak, DB Singh, M Sagar, M Baunthiyal… - Computer-aided drug …, 2020 - Springer
Drug discovery is an expensive and complicated process. The drug must fulfill some criteria
of being nontoxic, bioavailable, and potent. In the view of evermore stringent demands about …

Computational approaches in drug discovery and design

P Sharma, K Sharma, M Nandave - Computational Approaches in Drug …, 2023 - Elsevier
Drug development is a costly and time-consuming procedure. The medicine must meet
certain characteristics such as nontoxicity, bioavailability, and potency. Establishing a better …

[图书][B] Computer-aided drug design: QSAR, molecular docking, virtual screening, homology and pharmacophore modeling

A Thakur, V Mehta, P Nagu, K Goutam - 2024 - books.google.com
Computer-Aided Drug Design (CADD) is a comprehensive guide designed for both
beginners and experienced users in CADD. This book covers the fundamental principles …

Role of computer-aided drug design in drug development

R Gu, F Wu, Z Huang - Molecules, 2023 - mdpi.com
The introduction of computational techniques to pharmaceutical chemistry and molecular
biology in the 20th century has changed the way people develop drugs. The computeraided …

Computer-aided drug design

PV Bharatam - Drug discovery and development: From targets and …, 2021 - Springer
Abstract Computer-Aided Drug Design topic deals with the application of computer
hardware and software to provide solutions at every stage of drug discovery. QSAR methods …

Computational approaches in drug designing and their applications

DB Singh, RK Pathak - Experimental protocols in biotechnology, 2020 - Springer
Computational approaches have tremendous potential to speed up the process of drug
discovery. There are several tools based on the methods and algorithms of computer …

[图书][B] Computer-aided drug design

DB Singh - 2020 - Springer
The computer-aided drug design uses computational approaches for analysis of target,
screening, and interaction of ligands, simulation of target–ligand complex, optimization of …

[HTML][HTML] Computational methods in drug discovery

SP Leelananda, S Lindert - Beilstein journal of organic …, 2016 - beilstein-journals.org
The process for drug discovery and development is challenging, time consuming and
expensive. Computer-aided drug discovery (CADD) tools can act as a virtual shortcut …

Computational approaches for drug discovery

S Brogi - Molecules, 2019 - mdpi.com
Computational approaches represent valuable and essential tools in each step of the drug
discovery and development trajectory. Several computational methodologies are suitable to …

[图书][B] Concepts and experimental protocols of modelling and informatics in drug design

O Silakari, PK Singh - 2020 - books.google.com
Concepts and Experimental Protocols of Modelling and Informatics in Drug Design
discusses each experimental protocol utilized in the field of bioinformatics, focusing …