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data for aromatase 3D qsar modeling
L o a d i n g
Organization
United State Environmental Protection Agency - view all
Update frequencyunknown
Last updatedover 2 years ago
Format
Overview

computational chemistry data (very complex; need to be an expert to understand and use. This dataset is associated with the following publication: Lee, S., and M. Barron. 3D-QSAR Study of Steroidal and Azaheterocyclic Human Aromatase Inhibitors using Quantitative Profile of Protein-Ligand Interactions. Journal of Cheminformatics. Springer, New York, NY, USA, 10(2): 1-13, (2018).

3d-qsaradverse outcome pathwayaromatase inhibitorazaheterocycledual descriptorhydrophobic contactnitrogen-heme-iron coordinationsteroid
Additional Information
KeyValue
Dcat Modified2017-09-22
Dcat Publisher NameU.S. EPA Office of Research and Development (ORD)
Guidhttps://doi.org/10.23719/1394789
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