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Molecular Informatics

Known as: QSAR & Combinatorial Science 
Molecular Informatics is a peer-reviewed scientific journal published by Wiley VCH. It covers research in cheminformatics, quantitative structure… 
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Papers overview

Semantic Scholar uses AI to extract papers important to this topic.
Review
2015
Review
2015
Proteochemometric (PCM) modelling is a computational method to model the bioactivity of multiple ligands against multiple related… 
Review
2010
Review
2010
This paper presents an overview on recent developments of imogolite reinforced nanocomposites, including fundamental structure… 
Highly Cited
2009
Highly Cited
2009
High purity Al (99.99%) was subjected to severe plastic deformation through twist extrusion at room temperature. Microstructures… 
2007
2007
The molecular electron density carries the complete information about the molecule. This information is stored in the shape and… 
2006
2006
The title compound (systematic name: {5-[(7-chloroquinolinium-4-yl)amino]-2-hydroxy­benzyl}dimethylammonium dichloride dihydrate… 
2005
2005
An efficiency of Monte Carlo (MC) docking simulations was examined for the prediction of chiral discrimination by cyclodextrins… 
2003
2003
The aMAZE database (http://www.amaze.ulb.ac.be) manages information on the molecular functions of genes and proteins, their… 
2002
2002
A new insecticide, bistrifluron acts as an inhibitor of insect development and interferes with the cuticle formation of insects… 
2002
2002
Let's put a 'toe in the water'of molecular informatics. There are 50 million or so accessible chemical substances, around 6…