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Journal of Cheminformatics
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May 7, 2023
OWSum: algorithmic odor prediction and insight into structure-odor relationships
Doris Schicker, Satnam Singh, Jessica Freiherr, et al.
Journal of Cheminformatics
|
November 2, 2012
A rule-based algorithm for automatic bond type perception
Qian Zhang, Wei Zhang, Youyong Li, et al.
Journal of Cheminformatics
|
June 24, 2014
Efficient enumeration of monocyclic chemical graphs with given path frequencies
Masaki Suzuki, Hiroshi Nagamochi, Tatsuya Akutsu
Journal of Cheminformatics
|
June 25, 2014
Self organising hypothesis networks: a new approach for representing and structuring SAR knowledge
Thierry Hanser, Chris Barber, Edward Rosser, et al.
Journal of Cheminformatics
|
June 25, 2014
Estimation of acute oral toxicity in rat using local lazy learning
Jing Lu, Jianlong Peng, Jinan Wang, et al.
Journal of Cheminformatics
|
July 1, 2014
The influence of negative training set size on machine learning-based virtual screening
Rafał Kurczab, Sabina Smusz, Andrzej J Bojarski
Journal of Cheminformatics
|
July 1, 2014
In Silico target fishing: addressing a "Big Data" problem by ligand-based similarity rankings with data fusion
Xian Liu, Yuan Xu, Shanshan Li, et al.
Journal of Cheminformatics
|
May 23, 2014
Using cheminformatics to predict cross reactivity of "designer drugs" to their currently available immunoassays
Matthew D Krasowski, Sean Ekins
Journal of Cheminformatics
|
April 2, 2023
qHTSWaterfall: 3-dimensional visualization software for quantitative high-throughput screening (qHTS) data
Bryan Queme, John C Braisted, Patricia Dranchak, et al.
Journal of Cheminformatics
|
September 2, 2022
From theory to experiment: transformer-based generation enables rapid discovery of novel reactions
Xinqiao Wang, Chuansheng Yao, Yun Zhang, et al.
Page
of 137
Search research articles
Search
Showing results (851-860 of 1,363) with videos related to
Sort By:
Page
of 137
Journal of Cheminformatics
|
May 7, 2023
OWSum: algorithmic odor prediction and insight into structure-odor relationships
Doris Schicker, Satnam Singh, Jessica Freiherr, et al.
Journal of Cheminformatics
|
November 2, 2012
A rule-based algorithm for automatic bond type perception
Qian Zhang, Wei Zhang, Youyong Li, et al.
Journal of Cheminformatics
|
June 24, 2014
Efficient enumeration of monocyclic chemical graphs with given path frequencies
Masaki Suzuki, Hiroshi Nagamochi, Tatsuya Akutsu
Journal of Cheminformatics
|
June 25, 2014
Self organising hypothesis networks: a new approach for representing and structuring SAR knowledge
Thierry Hanser, Chris Barber, Edward Rosser, et al.
Journal of Cheminformatics
|
June 25, 2014
Estimation of acute oral toxicity in rat using local lazy learning
Jing Lu, Jianlong Peng, Jinan Wang, et al.
Journal of Cheminformatics
|
July 1, 2014
The influence of negative training set size on machine learning-based virtual screening
Rafał Kurczab, Sabina Smusz, Andrzej J Bojarski
Journal of Cheminformatics
|
July 1, 2014
In Silico target fishing: addressing a "Big Data" problem by ligand-based similarity rankings with data fusion
Xian Liu, Yuan Xu, Shanshan Li, et al.
Journal of Cheminformatics
|
May 23, 2014
Using cheminformatics to predict cross reactivity of "designer drugs" to their currently available immunoassays
Matthew D Krasowski, Sean Ekins
Journal of Cheminformatics
|
April 2, 2023
qHTSWaterfall: 3-dimensional visualization software for quantitative high-throughput screening (qHTS) data
Bryan Queme, John C Braisted, Patricia Dranchak, et al.
Journal of Cheminformatics
|
September 2, 2022
From theory to experiment: transformer-based generation enables rapid discovery of novel reactions
Xinqiao Wang, Chuansheng Yao, Yun Zhang, et al.
Page
of 137