Prediction of carcinogenicity from molecular structure; modification and reinvestigation of the method

Ildikó Magdó, G. Ferenczy, Zoltán Bencz

Research output: Article

1 Citation (Scopus)

Abstract

The method of Lewis and coworkers for predicting the affinity of molecules for cytochrome P448 is studied. Parameters are modified to clarify their meaning and to simplify their calculation. Additional molecules are involved in the study. Geometric requirements for obtaining reliable parameters and the possibility of predicting carcinogenicity are discussed.

Original languageEnglish
Pages (from-to)201-207
Number of pages7
JournalCancer Letters
Volume81
Issue number2
DOIs
Publication statusPublished - jún. 30 1994

Fingerprint

Cytochromes
Molecular Structure

ASJC Scopus subject areas

  • Cancer Research
  • Molecular Biology
  • Oncology

Cite this

Prediction of carcinogenicity from molecular structure; modification and reinvestigation of the method. / Magdó, Ildikó; Ferenczy, G.; Bencz, Zoltán.

In: Cancer Letters, Vol. 81, No. 2, 30.06.1994, p. 201-207.

Research output: Article

@article{9c7e12d1171b4657afea76446434c4c5,
title = "Prediction of carcinogenicity from molecular structure; modification and reinvestigation of the method",
abstract = "The method of Lewis and coworkers for predicting the affinity of molecules for cytochrome P448 is studied. Parameters are modified to clarify their meaning and to simplify their calculation. Additional molecules are involved in the study. Geometric requirements for obtaining reliable parameters and the possibility of predicting carcinogenicity are discussed.",
keywords = "Carcinogenicity, Cytochrome P448, Cytochrome P450, Molecular structure",
author = "Ildik{\'o} Magd{\'o} and G. Ferenczy and Zolt{\'a}n Bencz",
year = "1994",
month = "6",
day = "30",
doi = "10.1016/0304-3835(94)90203-8",
language = "English",
volume = "81",
pages = "201--207",
journal = "Cancer Letters",
issn = "0304-3835",
publisher = "Elsevier Ireland Ltd",
number = "2",

}

TY - JOUR

T1 - Prediction of carcinogenicity from molecular structure; modification and reinvestigation of the method

AU - Magdó, Ildikó

AU - Ferenczy, G.

AU - Bencz, Zoltán

PY - 1994/6/30

Y1 - 1994/6/30

N2 - The method of Lewis and coworkers for predicting the affinity of molecules for cytochrome P448 is studied. Parameters are modified to clarify their meaning and to simplify their calculation. Additional molecules are involved in the study. Geometric requirements for obtaining reliable parameters and the possibility of predicting carcinogenicity are discussed.

AB - The method of Lewis and coworkers for predicting the affinity of molecules for cytochrome P448 is studied. Parameters are modified to clarify their meaning and to simplify their calculation. Additional molecules are involved in the study. Geometric requirements for obtaining reliable parameters and the possibility of predicting carcinogenicity are discussed.

KW - Carcinogenicity

KW - Cytochrome P448

KW - Cytochrome P450

KW - Molecular structure

UR - http://www.scopus.com/inward/record.url?scp=0028307857&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=0028307857&partnerID=8YFLogxK

U2 - 10.1016/0304-3835(94)90203-8

DO - 10.1016/0304-3835(94)90203-8

M3 - Article

C2 - 8012938

AN - SCOPUS:0028307857

VL - 81

SP - 201

EP - 207

JO - Cancer Letters

JF - Cancer Letters

SN - 0304-3835

IS - 2

ER -