(Q33436371)

26 July 2017

title

Bioisosteric similarity of molecules based on structural alignment and observed chemical replacements in drugs (English)

1 reference

26 July 2017

Markus Krier

1

1 reference

26 July 2017

Michael C Hutter

series ordinal

2

1 reference

26 July 2017

publication date

1 May 2009

1 reference

Journal of Chemical Information and Modeling

26 July 2017

published in

1 reference

26 July 2017

volume

49

1 reference

26 July 2017

issue

5

1 reference

26 July 2017

page(s)

1280-1297

1 reference

SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules

26 July 2017

cites work

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI00057A005

Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. 4. Additional parameters for hydrophobic and dispersive interactions and their application for an automated superposition of ...

11 September 2021

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI00063A006

Chemical Similarity Searching

12 September 2021

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI9800211

The Blue Obelisk-interoperability in chemical informatics

12 September 2021

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI050400B

Reoptimization of MDL keys for use in drug discovery

30 October 2021

1 reference

25 May 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI010132R

The quest for bioisosteric replacements

1 reference

https://opencitations.net/index/api/v1/citations/10.1021/CI0503964

4D-fingerprints, universal QSAR and QSPR descriptors

1 October 2024

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI049898S

The most common chemical replacements in drug-like compounds

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI0100806

Cheminformatics Analysis of Organic Substituents: Identification of the Most Common Substituents, Calculation of Substituent Properties, and Automatic Identification of Drug-like Bioisosteric Groups

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI0255782

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI025592E

Is there a difference between leads and drugs? A historical perspective

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI010366A

RECAPRetrosynthetic Combinatorial Analysis Procedure: A Powerful New Technique for Identifying Privileged Molecular Fragments with Useful Applications in Combinatorial Chemistry

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI970429I

SMILES. 2. Algorithm for generation of unique SMILES notation

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI00062A008

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI990263G

Design and evaluation of a molecular fingerprint involving the transformation of property descriptor values into a binary classification scheme

1 reference

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI030285+

Identifiers

DOI

10.1021/CI8003418

1 reference

26 July 2017

DBLP publication ID

journals/jcisd/KrierH09

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference