Sentence examples for based on chemical knowledge from inspiring English sources
The RECAP function electronically fragments and recombines molecules based on chemical knowledge of 11 chemical bond types derived from common chemical reactions [27].
To answer these and other related questions, the standard strategies have evolved from trial-and-error methodologies based on chemical knowledge, accumulated experience, and common sense into a clearly multidisciplinary science that allows one to reach the molecular design of tailor-made enzyme catalysts.
Since there is no atom mapping information provided within the KEGG database, the example reactions had to be identified manually based on chemical knowledge.
In this paper, we present a multiclass molecular knowledge framework which is based on chemical graph theory and chemical knowledge.
Different algorithms have been developed in the past towards this goal, following distinct approaches spanning constraint-based modeling, graph-based methods and knowledge-based systems based on chemical rules.
To our knowledge, there are no methods which predict drug target interactions based on chemical, genomic and pharmacological data simultaneously.
Dixon methods [ 8] address the fat suppression problem based on chemical shift but have never been implemented at 7T in a small animal scanner to our knowledge.
Structural applicability domain restricts chemical compounds based on chemical structure.
The predictor based on chemical interactions outperformed the predictor based on chemical similarities.
