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A Platform for in silico Modeling of Physiological Systems

2007 29th Annual International Conference of the IEEE Engineering in Medicine and Biology Society, 2007
This paper describes our challenge of developing base systems necessary and useful for a physiome typed platform for physiological modeling and simulation across multiple scales of time and size through diverse hierarchies of living organisms. Our base systems include a CellML compatible standardized description of structure and dynamic equations ...
Toshihiro, Kawazu   +4 more
openaire   +2 more sources

Comparison of In Silico Models for Prediction of Mutagenicity

Journal of Environmental Science and Health, Part C, 2013
Using a dataset with more than 6000 compounds, the performance of eight quantitative structure activity relationships (QSAR) models was evaluated: ACD/Tox Suite, Absorption, Distribution, Metabolism, Elimination, and Toxicity of chemical substances (ADMET) predictor, Derek, Toxicity Estimation Software Tool (T.E.S.T.), TOxicity Prediction by Komputer ...
Nazanin G, Bakhtyari   +4 more
openaire   +2 more sources

In Silico Models

2022
Daniel J. Pope   +2 more
openaire   +1 more source

In silico modelling--pharmacophores and hERG channel models.

Novartis Foundation symposium, 2005
In computational drug design, modelling studies are undertaken following two main strategies that depend on which information is available. If experimental data exist only for the molecules displaying the biological property of interest, a so-called ligand-based approach is taken; if information is available on the macromolecular target(s) of the ...
RECANATINI, MAURIZIO   +2 more
openaire   +2 more sources

From Infection to Immunity: Understanding the Response to SARS-CoV2 Through In-Silico Modeling

Frontiers in Immunology, 2021
Arcangelo Liso   +2 more
exaly  

Allosteric Binding Sites of Aβ Peptides on the Acetylcholine Synthesizing Enzyme ChAT as Deduced by In Silico Molecular Modeling

International Journal of Molecular Sciences, 2022
Rajnish Kumar   +2 more
exaly  

High Density Bioprocessing of Human Pluripotent Stem Cells by Metabolic Control and in Silico Modeling

Stem Cells Translational Medicine, 2021
Kevin Ullmann   +2 more
exaly  

In Silico ADME Modeling

2021
Ioana Oprisiu, Susanne Winiwarter
openaire   +1 more source

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