SMIfp (SMILES fingerprint) Chemical Space for Virtual Screening and Visualization of Large Databases of Organic Molecules-Reference-Cited by-同舟云学术

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SMIfp (SMILES fingerprint) Chemical Space for Virtual Screening and Visualization of Large Databases of Organic Molecules

Published:2013-07-30 Issue:8 Volume:53 Page:1979-1989
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Schwartz Julian¹,Awale Mahendra¹,Reymond Jean-Louis¹

Affiliation:

1. Department of Chemistry and Biochemistry, University of Berne, Freiestrasse 3, 3012 Berne Switzerland

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci400206h

Reference54 articles.

1. The art and practice of structure-based drug design: A molecular modeling perspective

2. Chemical space

3. Hit and lead generation: beyond high-throughput screening

4. Virtual ligand screening: strategies, perspectives and limitations

5. Docking and chemoinformatic screens for new ligands and targets

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