Thomas Blaschke - Search Results

Year	Number of Results
2005	1
2007	1
2008	1
2011	1
2012	1
2013	1
2014	5
2015	3
2016	3
2017	4
2018	4
2019	7
2020	12
2021	10
2022	2

1

The rise of deep learning in drug discovery.

Chen H, Engkvist O, Wang Y, Olivecrona M, Blaschke T. Chen H, et al. Among authors: blaschke t. Drug Discov Today. 2018 Jun;23(6):1241-1250. doi: 10.1016/j.drudis.2018.01.039. Epub 2018 Jan 31. Drug Discov Today. 2018. PMID: 29366762 Free article. Review.

2

Prediction of Promiscuity Cliffs Using Machine Learning.

Blaschke T, Feldmann C, Bajorath J. Blaschke T, et al. Mol Inform. 2021 Jan;40(1):e2000196. doi: 10.1002/minf.202000196. Epub 2020 Sep 29. Mol Inform. 2021. PMID: 32881355 Free PMC article.

3

Fine-tuning of a generative neural network for designing multi-target compounds.

Blaschke T, Bajorath J. Blaschke T, et al. J Comput Aided Mol Des. 2021 May 28. doi: 10.1007/s10822-021-00392-8. Online ahead of print. J Comput Aided Mol Des. 2021. PMID: 34046745

4

Compound dataset and custom code for deep generative multi-target compound design.

Blaschke T, Bajorath J. Blaschke T, et al. Future Sci OA. 2021 Apr 30;7(6):FSO715. doi: 10.2144/fsoa-2021-0033. Future Sci OA. 2021. PMID: 34046209 Free PMC article.

5

Comparison of multi-criteria and artificial intelligence models for land-subsidence susceptibility zonation.

Arabameri A, Chandra Pal S, Rezaie F, Chakrabortty R, Chowdhuri I, Blaschke T, Thi Ngo PT. Arabameri A, et al. Among authors: blaschke t. J Environ Manage. 2021 Apr 15;284:112067. doi: 10.1016/j.jenvman.2021.112067. Epub 2021 Feb 5. J Environ Manage. 2021. PMID: 33556831

6

REINVENT 2.0: An AI Tool for De Novo Drug Design.

Blaschke T, Arús-Pous J, Chen H, Margreitter C, Tyrchan C, Engkvist O, Papadopoulos K, Patronov A. Blaschke T, et al. J Chem Inf Model. 2020 Dec 28;60(12):5918-5922. doi: 10.1021/acs.jcim.0c00915. Epub 2020 Oct 29. J Chem Inf Model. 2020. PMID: 33118816

7

Memory-assisted reinforcement learning for diverse molecular de novo design.

Blaschke T, Engkvist O, Bajorath J, Chen H. Blaschke T, et al. J Cheminform. 2020 Nov 10;12(1):68. doi: 10.1186/s13321-020-00473-0. J Cheminform. 2020. PMID: 33292554 Free PMC article.

8

Big Earth data: disruptive changes in Earth observation data management and analysis?

Sudmanns M, Tiede D, Lang S, Bergstedt H, Trost G, Augustin H, Baraldi A, Blaschke T. Sudmanns M, et al. Among authors: blaschke t. Int J Digit Earth. 2019 Mar 14;13(7):832-850. doi: 10.1080/17538947.2019.1585976. Int J Digit Earth. 2019. PMID: 32939223 Free PMC article. Review.

9

Multi-hazard probability assessment and mapping in Iran.

Pourghasemi HR, Gayen A, Panahi M, Rezaie F, Blaschke T. Pourghasemi HR, et al. Among authors: blaschke t. Sci Total Environ. 2019 Nov 20;692:556-571. doi: 10.1016/j.scitotenv.2019.07.203. Epub 2019 Jul 17. Sci Total Environ. 2019. PMID: 31351297

10

Application of Generative Autoencoder in De Novo Molecular Design.

Blaschke T, Olivecrona M, Engkvist O, Bajorath J, Chen H. Blaschke T, et al. Mol Inform. 2018 Jan;37(1-2):1700123. doi: 10.1002/minf.201700123. Epub 2017 Dec 13. Mol Inform. 2018. PMID: 29235269 Free PMC article.

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