Literature DB >> 10935454

Neural networks are useful tools for drug design.

G Schneider1.   

Abstract

A profound understanding of molecular recognition processes and the underlying molecular interaction patterns is a prerequisite for future progress and success in rational drug design. Neural networks could play an important role in guiding the Drug Discovery process through the extraction of relevant molecular features.

Mesh:

Year:  2000        PMID: 10935454     DOI: 10.1016/s0893-6080(99)00094-5

Source DB:  PubMed          Journal:  Neural Netw        ISSN: 0893-6080


  6 in total

1.  Drug repurposing: mining protozoan proteomes for targets of known bioactive compounds.

Authors:  Adam Sateriale; Kovi Bessoff; Indra Neil Sarkar; Christopher D Huston
Journal:  J Am Med Inform Assoc       Date:  2013-06-11       Impact factor: 4.497

Review 2.  Automating drug discovery.

Authors:  Gisbert Schneider
Journal:  Nat Rev Drug Discov       Date:  2017-12-15       Impact factor: 84.694

Review 3.  Rethinking drug design in the artificial intelligence era.

Authors:  Petra Schneider; W Patrick Walters; Alleyn T Plowright; Norman Sieroka; Jennifer Listgarten; Robert A Goodnow; Jasmin Fisher; Johanna M Jansen; José S Duca; Thomas S Rush; Matthias Zentgraf; John Edward Hill; Elizabeth Krutoholow; Matthias Kohler; Jeff Blaney; Kimito Funatsu; Chris Luebkemann; Gisbert Schneider
Journal:  Nat Rev Drug Discov       Date:  2019-12-04       Impact factor: 84.694

4.  Deep-learning: investigating deep neural networks hyper-parameters and comparison of performance to shallow methods for modeling bioactivity data.

Authors:  Alexios Koutsoukas; Keith J Monaghan; Xiaoli Li; Jun Huan
Journal:  J Cheminform       Date:  2017-06-28       Impact factor: 5.514

5.  Transformer-Based Generative Model Accelerating the Development of Novel BRAF Inhibitors.

Authors:  Lijuan Yang; Guanghui Yang; Zhitong Bing; Yuan Tian; Yuzhen Niu; Liang Huang; Lei Yang
Journal:  ACS Omega       Date:  2021-12-01

6.  Distinguishing compounds with anticancer activity by ANN using inductive QSAR descriptors.

Authors:  Kunal Jaiswal; Pradeep Kumar Naik
Journal:  Bioinformation       Date:  2008-07-30
  6 in total

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