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Chemical similarity
Known as:
Molecular similarity
, Similarity
Chemical similarity (or molecular similarity) refers to the similarity of chemical elements, molecules or chemical compounds with respect to either…
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Related topics
Related topics
9 relations
Bloom filter
Chemical space
Euclidean distance
Graph theory
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Broader (1)
Cheminformatics
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
2017
2017
Synthesis of a bone like composite material derived from waste pearl oyster shells for potential bone tissue bioengineering applications
R. Brundavanam
,
D. Fawcett
,
G. Poinern
2017
Corpus ID: 55673946
Background: Hydroxyapatite is generally considered a viable substitute for bone in a number of medical procedures such as bone…
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2013
2013
Three-dimensional quantitative structure–activity relationship CoMFA/CoMSIA on pyrrolidine-based tartrate diamides as TACE inhibitors
P. Murumkar
,
M. Sharma
,
A. C. Shinde
,
K. Bothara
Medicinal Chemistry Research
2013
Corpus ID: 15514742
A series of pyrrolidine-based tartrate diamides having selective tumor necrosis factor-α converting enzyme (TACE) inhibitory…
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2006
2006
Guide for Weed Management in Nebraska
M. Bernards
,
S. Knezevic
,
+9 authors
L. Schulze
2006
Corpus ID: 127046148
2006
2006
The 322 ka Tiribí Tuff: stratigraphy, geochronology and mechanisms of deposition of the largest and most recent ignimbrite in the Valle Central, Costa Rica
W. Pérez
,
G. Alvarado
,
P. Gans
2006
Corpus ID: 58892024
The Tiribí Tuff covered much of the Valle Central of Costa Rica, currently the most densely populated area in the country (∼2.4…
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Review
1996
Review
1996
Fundamental principles of molecular modeling
W. Gans
,
A. Amann
,
J. Boeyens
1996
Corpus ID: 60325461
Molecular similarity has always been an important conceptual tool of chemists, yet systematic approaches to molecular similarity…
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1994
1994
On the calculation of ab initio quantum molecular similarities for large systems: Fitting the electron density
J. Mestres
,
M. Solà
,
M. Duran
,
R. Carbó-Dorca
Journal of Computational Chemistry
1994
Corpus ID: 44999397
A set of procedures for rapid calculation of quantum molecular similarities from ab initio wave functions is discussed. In all…
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1993
1993
The interaction of N with Ti and the oxidation of TiN studied by soft X-ray absorption spectroscopy
L. Soriano
,
M. Abbate
,
H. Pen
,
M. Czyżyk
,
J. Fuggle
1993
Corpus ID: 56316084
1993
1993
Computers in drug design
W. Richards
1993
Corpus ID: 59393800
Abstract
1989
1989
Are ant alarm-defense secretions only for alarm defense ?
J. Brand
,
H. M. Page
,
W. Lindner
,
A. J. Markovetz
Die Naturwissenschaften
1989
Corpus ID: 30566988
Les secretions defensives des fourmis possedent la propriete d'inhiber la germination de graines
1945
1945
Chemical determination and urinary excretion of the metabolite N'-methylnicotinamide.
M. Hochberg
,
D. Melniok
,
B. L. Osee
1945
Corpus ID: 7612166
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