Literature DB >> 29668343

Advancing drug discovery via GPU-based deep learning.

Erik Gawehn1, Jan A Hiss1, J B Brown2, Gisbert Schneider1.   

Abstract

Keywords:  Artificial neural network; chemoinformatics; drug design; graphics processing unit; virtual screening

Mesh：

Year:  2018        PMID： 29668343     DOI： 10.1080/17460441.2018.1465407

Source DB:  PubMed          Journal:  Expert Opin Drug Discov        ISSN： 1746-0441            Impact factor:   6.098


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  8 in total

1.  DeepH-DTA: Deep Learning for Predicting Drug-Target Interactions: A Case Study of COVID-19 Drug Repurposing.

Authors:  Mohamed Abdel-Basset; Hossam Hawash; Mohamed Elhoseny; Ripon K Chakrabortty; Michael Ryan
Journal:  IEEE Access       Date:  2020-09-15       Impact factor: 3.367

2.  Target Prediction Model for Natural Products Using Transfer Learning.

Authors:  Bo Qiang; Junyong Lai; Hongwei Jin; Liangren Zhang; Zhenming Liu
Journal:  Int J Mol Sci       Date:  2021-04-28       Impact factor: 5.923

Review 3.  Molecular Docking: Shifting Paradigms in Drug Discovery.

Authors:  Luca Pinzi; Giulio Rastelli
Journal:  Int J Mol Sci       Date:  2019-09-04       Impact factor: 5.923

4.  ADMET evaluation in drug discovery. 20. Prediction of breast cancer resistance protein inhibition through machine learning.

Authors:  Dejun Jiang; Tailong Lei; Zhe Wang; Chao Shen; Dongsheng Cao; Tingjun Hou
Journal:  J Cheminform       Date:  2020-03-05       Impact factor: 5.514

Review 5.  Computational systems biology in disease modeling and control, review and perspectives.

Authors:  Rongting Yue; Abhishek Dutta
Journal:  NPJ Syst Biol Appl       Date:  2022-10-03

Review 6.  In silico Strategies to Support Fragment-to-Lead Optimization in Drug Discovery.

Authors:  Lauro Ribeiro de Souza Neto; José Teófilo Moreira-Filho; Bruno Junior Neves; Rocío Lucía Beatriz Riveros Maidana; Ana Carolina Ramos Guimarães; Nicholas Furnham; Carolina Horta Andrade; Floriano Paes Silva
Journal:  Front Chem       Date:  2020-02-18       Impact factor: 5.221

Review 7.  Artificial Intelligence in Drug Design.

Authors:  Gerhard Hessler; Karl-Heinz Baringhaus
Journal:  Molecules       Date:  2018-10-02       Impact factor: 4.411

8.  Artificial intelligence, robotics and eye surgery: are we overfitted?

Authors:  Müller G Urias; Niravkumar Patel; Changyan He; Ali Ebrahimi; Ji Woong Kim; Iulian Iordachita; Peter L Gehlbach
Journal:  Int J Retina Vitreous       Date:  2019-12-16
  8 in total

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