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cheminformatics
Known as:
chemical informatics
National Institutes of Health
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Related topics
Related topics
2 relations
Broader (1)
Informatics (discipline)
Narrower (1)
chemical information system
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
2018
2018
Cheminformatics and the Mean
G. Schneider
,
K. Baumann
Molecular Informatics
2018
Corpus ID: 3304719
Cheminformatics intends to accelerate and improve decision making, primarily in the drug discovery process, e. g., by compound…
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2017
2017
Crystallography as an introduction to cheminformatics
S. Coles
2017
Corpus ID: 103516652
Information management and its subsequent analysis to derive new knowledge is ubiquitous in the digital age, with companies such…
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2014
2014
System biology modeling : the insights for computational drug discovery
Hui Huang
2014
Corpus ID: 74247276
2014
2014
Is there a role for the integral equation theory of molecular liquids in chemical informatics
David S. Palmer
,
M. Fedorov
2014
Corpus ID: 91893170
We propose a fast and efficient method to compute molecular descriptors based on the Integral Equation Theory (IET) of Molecular…
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2013
2013
Abstract P2-09-11: Identification of a novel inhibitor of triple-negative breast cancer cell growth by screening of a small molecule library
Tomoyuki Fujita
,
T. Mizukami
,
T. Okawara
,
K. Inoue
,
M. Fujimori
2013
Corpus ID: 70574041
Background : Triple-negative breast cancers (TNBC) are defined as not having amplification of the estrogen receptor, progesterone…
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2012
2012
Comparative Docking Studies on Neurological and Psychological Disorders Genes (BDNF and CLCN2) using Cheminformatics Protocols
M. Balaji
,
T. Radha
,
I. P.
2012
Corpus ID: 196689094
Epilepsy is one of the most common of the serious neurological disorders. 1 About 3% of people will be diagnosed with epilepsy at…
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2011
2011
Development of chemical informatics tools for calculating fundamental properties of atmospheric aerosol components.
D. Topping
,
M. Barley
,
G. Mcfiggans
,
D. Lowe
2011
Corpus ID: 99076208
2007
2007
Tools for drug discovery: In silico screening with chemical informatics
Nature
2007
Corpus ID: 27900271
Review
2001
Review
2001
DIVISION OF COMPUTERS IN CHEMISTRY ABSTRACTS
B. Bursten
,
Michele L. Goodbread
,
+6 authors
Hui Li
2001
Corpus ID: 51842775
text not available. 52. FINGERPRINT ANALYSIS OF PROTEINS AND LIGANDS FOR HIGH-THROUGHPUT SCREENING. W. Todd Wipke, Zheng Yang…
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2001
2001
Glycolipids Chemical Informatics
R. Hashim
,
S. Janarthanan
2001
Corpus ID: 88560700
Information on new chemicals and biologically active compounds increase tremendously through the lntemet database. Our current…
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