Next Article in Journal
Previous Article in Journal
Molecules 2001, 6(11), 915-926; doi:10.3390/61100915
Article

A New Effective Algorithm for the Unambiguous Identification of the Stereochemical Characteristics of Compounds During Their Registration in Databases

1 and 2,3,*
Received: 15 July 2001; Accepted: 24 October 2001 / Published: 31 October 2001
Download PDF [59 KB, uploaded 18 June 2014]
Abstract: A new effective algorithm for handling of geometry at chiral centers for the processing of stereochemical structures during their unambiguous registration in databases was designed, programmed and implemented. The chemical and mathematical reasoning behind the algorithm are discussed in detail. Its advantages- in comparison to the methods used so far - are illustrated for the manual as well as for the computerassisted assignment of stereodescriptors based on the CIP ranking procedure.
Keywords: Stereochemistry; CIP; Stereodescriptors; Determinant algorithm; Chirality Stereochemistry; CIP; Stereodescriptors; Determinant algorithm; Chirality
This is an open access article distributed under the Creative Commons Attribution License which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Export to BibTeX |
EndNote


MDPI and ACS Style

Cieplak, T.; Wisniewski, J.L. A New Effective Algorithm for the Unambiguous Identification of the Stereochemical Characteristics of Compounds During Their Registration in Databases. Molecules 2001, 6, 915-926.

AMA Style

Cieplak T, Wisniewski JL. A New Effective Algorithm for the Unambiguous Identification of the Stereochemical Characteristics of Compounds During Their Registration in Databases. Molecules. 2001; 6(11):915-926.

Chicago/Turabian Style

Cieplak, T.; Wisniewski, J. L. 2001. "A New Effective Algorithm for the Unambiguous Identification of the Stereochemical Characteristics of Compounds During Their Registration in Databases." Molecules 6, no. 11: 915-926.



Molecules EISSN 1420-3049 Published by MDPI AG, Basel, Switzerland RSS E-Mail Table of Contents Alert