Results 211 to 220 of about 141,530 (234)
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Strategies for Indirect Computer-Aided Drug Design

Pharmaceutical Research, 1993
This review is intended to describe some of the methods and procedures used for computer-aided drug design when the structure of the macromolecular target is unknown, as is the case for CNS active drugs. Strategies and methods used in computer-aided design of drugs in such instances must be "indirect," i.e., focusing on the characterization of the ...
G H, Loew, H O, Villar, I, Alkorta
openaire   +2 more sources

Computer-Aided Drug Design in Anticancer Drugs

MedScien, 2023
The fight against cancer is a significant global health issue, and creating effective anticancer medications is crucial to addressing this challenge. Traditional methods of developing these drugs are time-consuming and require substantial financial investment.
openaire   +1 more source

Computer-aided retrometabolic drug design: soft drugs

Expert Opinion on Drug Discovery, 2007
Soft drug design approaches aim to design new therapeutic agents that undergo facile, preferentially hydrolytic metabolism to produce inactive metabolites. This approach is general and can be used in essentially any therapeutic area, especially where the desired activity is localized, relatively short-lived or susceptible to easy titration.
openaire   +2 more sources

Application of variational graph encoders as an effective generalist algorithm in computer-aided drug design

Nature Machine Intelligence, 2023
H. Lam   +9 more
semanticscholar   +1 more source

Computer Aided Drug Design

International Journal of Biochemistry, 1990
  +4 more sources

Transforming Drug Design: Innovations in Computer-Aided Discovery for Biosimilar Agents

BioMedInformatics, 2023
Hamed Taherdoost, Taherdoost Hamed
exaly  

Computer-aided drug design against spike glycoprotein of SARS-CoV-2 to aid COVID-19 treatment

Heliyon, 2020
Muhammad Shehroz   +2 more
exaly  

Computer-Aided Drug Design Applied to Secondary Metabolites as Anticancer Agents

Current Topics in Medicinal Chemistry, 2020
Edeíldo Ferreira da Silva-Junior   +2 more
exaly  

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