Work

Individual Hydrogen‐Bond Strength QSPR Modelling with ISIDA Local Descriptors: a Step Towards Polyfunctional Molecules

Year: 2014

Type: article

Source: Molecular Informatics

DOI: 10.1002/minf.201400032

Authors: Fiorella Ruggiu, Vitaly Solov'ev, Gilles Marcou, Dragos Horvath, Jérôme Graton, Jean‐Yves Le Questel, Alexandre Varnek

Institutions: Centre National de la Recherche Scientifique, Institut de Chimie de Strasbourg, Chimie de la Matière Complexe, Université de Strasbourg, Russian Academy of Sciences, Frumkin Institute of Physical Chemistry and Electrochemistry Russian Academy of Sciences, Chimie et Interdisciplinarité, Synthèse, Analyse, Modélisation, Université de Nantes, Nantes Université

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Drug Discovery

Field: Pharmacology, Toxicology and Pharmaceutics

Domain: Life Sciences

Open Access status: closed

OpenAlex ID: W2111190386

FWCI: 1.951

Cites: 46

Cited by: 27

Related to: 10