Effects of multiple conformers per compound upon 3-D similarity search and bioassay data analysis
Published 2012 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
Effects of multiple conformers per compound upon 3-D similarity search and bioassay data analysis
Authors
Keywords
-
Journal
Journal of Cheminformatics
Volume 4, Issue 1, Pages 28
Publisher
Springer Nature
Online
2012-11-08
DOI
10.1186/1758-2946-4-28
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Database resources of the National Center for Biotechnology Information
- (2011) E. W. Sayers et al. NUCLEIC ACIDS RESEARCH
- PubChem's BioAssay Database
- (2011) Y. Wang et al. NUCLEIC ACIDS RESEARCH
- PubChem3D: Conformer generation
- (2011) Evan E Bolton et al. Journal of Cheminformatics
- PubChem3D: a new resource for scientists
- (2011) Evan E Bolton et al. Journal of Cheminformatics
- PubChem3D: Similar conformers
- (2011) Evan E Bolton et al. Journal of Cheminformatics
- PubChem3D: Diversity of shape
- (2011) Evan E Bolton et al. Journal of Cheminformatics
- PubChem3D: Shape compatibility filtering using molecular shape quadrupoles
- (2011) Sunghwan Kim et al. Journal of Cheminformatics
- PubChem3D: Biologically relevant 3-D similarity
- (2011) Sunghwan Kim et al. Journal of Cheminformatics
- Conformer Generation with OMEGA: Algorithm and Validation Using High Quality Structures from the Protein Databank and Cambridge Structural Database
- (2010) Paul C. D. Hawkins et al. Journal of Chemical Information and Modeling
- How Similar Are Similarity Searching Methods? A Principal Component Analysis of Molecular Descriptor Space
- (2009) Andreas Bender et al. Journal of Chemical Information and Modeling
- An overview of the PubChem BioAssay resource
- (2009) Yanli Wang et al. NUCLEIC ACIDS RESEARCH
- Parameterization and Conformational Sampling Effects in Pharmacophore Multiplet Searching
- (2008) Peter C. Fox et al. Journal of Chemical Information and Modeling
- Application of Belief Theory to Similarity Data Fusion for Use in Analog Searching and Lead Hopping
- (2008) Steven W. Muchmore et al. Journal of Chemical Information and Modeling
- Multiple protein structures and multiple ligands: effects on the apparent goodness of virtual screening results
- (2008) Robert P. Sheridan et al. JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
- Assessment of Scaffold Hopping Efficiency by Use of Molecular Interaction Fingerprints
- (2008) Jennifer Venhorst et al. JOURNAL OF MEDICINAL CHEMISTRY
Create your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create NowBecome a Peeref-certified reviewer
The Peeref Institute provides free reviewer training that teaches the core competencies of the academic peer review process.
Get Started