Literature DB >> 12105936

Comparative QSAR and the radical toxicity of various functional groups.

Cynthia D Selassie1, Rajni Garg, Sanjay Kapur, Alka Kurup, Rajeshwar P Verma, Suresh Babu Mekapati, Corwin Hansch.   

Abstract

Entities:  

Mesh：

Substances：

Year:  2002        PMID： 12105936     DOI： 10.1021/cr940024m

Source DB:  PubMed          Journal:  Chem Rev        ISSN： 0009-2665            Impact factor:   60.622


× No keyword cloud information.
  9 in total

1.  C-QSAR: a database of 18,000 QSARs and associated biological and physical data.

Authors:  Alka Kurup
Journal:  J Comput Aided Mol Des       Date:  2003 Feb-Apr       Impact factor: 3.686

2.  Comparative QSAR studies on PAMPA/modified PAMPA for high throughput profiling of drug absorption potential with respect to Caco-2 cells and human intestinal absorption.

Authors:  Rajeshwar P Verma; Corwin Hansch; Cynthia D Selassie
Journal:  J Comput Aided Mol Des       Date:  2007-01-26       Impact factor: 3.686

3.  QSPR modeling of detonation parameters and sensitivity of some energetic materials: DFT vs. PM3 calculations.

Authors:  Jianying Zhang; Gangling Chen; Xuedong Gong
Journal:  J Mol Model       Date:  2017-05-22       Impact factor: 1.810

4.  Polarizability: a promising descriptor to study chemical-biological interactions.

Authors:  Hiteshi Tandon; Prabhat Ranjan; Tanmoy Chakraborty; Vandana Suhag
Journal:  Mol Divers       Date:  2020-03-07       Impact factor: 2.943

5.  Development of a QSPR model for predicting thermal stabilities of nitroaromatic compounds taking into account their decomposition mechanisms.

Authors:  Guillaume Fayet; Patricia Rotureau; Laurent Joubert; Carlo Adamo
Journal:  J Mol Model       Date:  2010-12-21       Impact factor: 1.810

6.  Interdisciplinary analysis of drugs: Structural features and clinical data.

Authors:  Daniel Austin; Kumari Biswas; Kailee Pollock; Linh Nguyen
Journal:  J Clin Transl Sci       Date:  2022-04-29

7.  QSPR modeling of thermal stability of nitroaromatic compounds: DFT vs. AM1 calculated descriptors.

Authors:  Guillaume Fayet; Patricia Rotureau; Laurent Joubert; Carlo Adamo
Journal:  J Mol Model       Date:  2010-01-05       Impact factor: 1.810

8.  Curation and analysis of multitargeting agents for polypharmacological modeling.

Authors:  A Srinivas Reddy; Zhi Tan; Shuxing Zhang
Journal:  J Chem Inf Model       Date:  2014-08-29       Impact factor: 4.956

9.  Growth Inhibition and DNA Damage Induced by X-Phenols in Yeast: A Quantitative Structure-Activity Relationship Study.

Authors:  M Cristina Negritto; Clarissa Valdez; Jasmine Sharma; Christa Rosenberg; Cynthia R Selassie
Journal:  ACS Omega       Date:  2017-12-01
  9 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.