(Q45944255)

20 June 2018

title

Generative Recurrent Networks for De Novo Drug Design. (English)

1 reference

20 June 2018

Erratum: Generative Recurrent Networks for De Novo Drug Design.

main subject

recurrent neural network

1 reference

based on heuristic

inferred from title

corrigendum / erratum

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author

Gisbert Schneider

5

6

object named as

Gisbert Schneider

2 references

20 June 2018

20 June 2018

Alex T Müller

2

0 references

author name string

Anvita Gupta

1

1 reference

20 June 2018

Berend J H Huisman

3

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20 June 2018

Jens A Fuchs

4

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20 June 2018

publication date

2 November 2017

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20 June 2018

published in

Molecular Informatics

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20 June 2018

volume

37

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20 June 2018

issue

1-2

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20 June 2018

Molecular de-novo design through deep reinforcement learning

cites work

1 reference

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DEEP MOTIF DASHBOARD: VISUALIZING AND UNDERSTANDING GENOMIC SEQUENCES USING DEEP NEURAL NETWORKS.

22 June 2018

1 reference

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The Next Era: Deep Learning in Pharmaceutical Research

22 June 2018

1 reference

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Chemoinformatic Classification Methods and their Applicability Domain

22 June 2018

1 reference

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Deep Learning in Drug Discovery.

22 June 2018

1 reference

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Twenty years on: the impact of fragments on drug discovery

22 June 2018

1 reference

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A renaissance of neural networks in drug discovery.

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

De Novo Design at the Edge of Chaos

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Networks that learn the precise timing of event sequences.

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

22 June 2018

1 reference

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The Chemical Space Project

22 June 2018

1 reference

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Deep architectures and deep learning in chemoinformatics: the prediction of aqueous solubility for drug-like molecules

22 June 2018

1 reference

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Principles of early drug discovery

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Leadlikeness and structural diversity of synthetic screening libraries

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Computer-based de novo design of drug-like molecules

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Navigating chemical space for biology and medicine

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

22 June 2018

Long short-term memory

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Interactions of thrombin with benzamidine-based inhibitors

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

Generating Focused Molecule Libraries for Drug Discovery with Recurrent Neural Networks

22 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5836943

15 August 2018

Identifiers

DOI

10.1002/MINF.201700111

1 reference

20 June 2018

PMC publication ID

5836943

1 reference

20 June 2018

PubMed publication ID

29095571

1 reference

20 June 2018