Evaluation Framework for AI -driven Molecular Design of Multi-target Drugs: Brain Diseases as a Case Study
Author:
Affiliation:
1. Programa de Pós-graduação em Computação (PPGC)
2. Hub de Inovação em Inteligência Artificial (H2IA)
3. Universidade Federal de Pelotas (UFPel),Omixlab, Centro de Desenvolvimento Tecnológico (CDTec),Brazil
Publisher
IEEE
Link
http://xplorestaging.ieee.org/ielx8/10609966/10611750/10611839.pdf?arnumber=10611839
Reference35 articles.
1. A Guide to In Silico Drug Design
2. Estimation of the size of drug-like chemical space based on gdb-17 data;Polishchuk;Journal of Computer-Aided Molecular Design,2013
3. De novo molecular design and generative models;Meyers;Drug Discovery Today,2021
4. Shifting from the single to the multitarget paradigm in drug discovery;Medina-Franco;Drug Discovery Today,2013
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