Quantitative Predictions for Molecular Initiating Events Using Three-Dimensional Quantitative Structure–Activity Relationships

نویسندگان
چکیده

برای دانلود رایگان متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Obtaining Quantitative Predictions from Monotone Relationships

Tasks such as forecasting, diagnosis, and planning frequently require quantitative predictions . Typically, quantitative predictions are obtained by characterizing a system in terms of algebraic relationships and then using these relationships to compute quantitative predictions from numerical data . For real-life systems, such as mainframe operating systems, an algebraic characterization is of...

متن کامل

Peripheries of Molecular Projection in Three-dimensional Space and Studies of Quantitative Structure-activity Relationships

A new index, i.e., the periphery representation of the projection of a molecule from 3D space to a 2D plane is described. The results, correlation with toxicity of substituted nitrobenzenes, obtained by using periphery descriptors are much better than that obtained by using the areas (i.e., shadows) of projections of the compounds. Even better results were achieved by using the combination of p...

متن کامل

Quantitative performance characterization of three-dimensional noncontact fluorescence molecular tomography.

Fluorescent proteins and dyes are routine tools for biological research to describe the behavior of genes, proteins, and cells, as well as more complex physiological dynamics such as vessel permeability and pharmacokinetics. The use of these probes in whole body in vivo imaging would allow extending the range and scope of current biomedical applications and would be of great interest. In order ...

متن کامل

Using three-dimensional quantitative structure-activity relationships to examine estrogen receptor binding affinities of polychlorinated hydroxybiphenyls.

Certain phenyl-substituted hydrocarbons of environmental concern have the potential to disrupt the endocrine system of animals, apparently in association with their estrogenic properties. Competition with natural estrogens for the estrogen receptor is a possible mechanism by which such effects could occur. We used comparative molecular field analysis (CoMFA), a three-dimensional quantitative st...

متن کامل

Quantitative analysis of three-dimensional biological cells using interferometric microscopy

Live biological cells are three-dimensional microscopic objects that constantly adjust their sizes, shapes and other biophysical features. Wide-field digital interferometry (WFDI) is a holographic technique that is able to record the complex wavefront of the light which has interacted with in-vitro cells in a single camera exposure, where no exogenous contrast agents are required. However, simp...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

ژورنال

عنوان ژورنال: Chemical Research in Toxicology

سال: 2019

ISSN: 0893-228X,1520-5010

DOI: 10.1021/acs.chemrestox.9b00136