3D-MoRSE descriptors explained

Author:

Devinyak OlegORCID,Havrylyuk Dmytro,Lesyk Roman

Publisher

Elsevier BV

Subject

Materials Chemistry,Computer Graphics and Computer-Aided Design,Physical and Theoretical Chemistry,Spectroscopy

Reference31 articles.

1. On the physical interpretation of QSAR models;Stanton;J. Chem. Inf. Comput. Sci.,2003

2. Handbook of Molecular Descriptors;Todeschini,2000

3. How not to develop a quantitative structure–activity or structure–property relationship (QSAR/QSPR);Dearden;SAR QSAR Environ. Res.,2009

4. Guidance document on the validation of (quantitative) structure–activity relationship ((Q)SAR) models;Organization for Economic Co-operation and Development,2007

5. SD-modelling and prediction by WHIM descriptors. Part 5. Theory development and chemical meaning of WHIM descriptors;Todeschini;Quant. Struct.-Act. Relat.,1997

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