ChemPlot, a Python Library for Chemical Space Visualization**-Reference-Cited by-同舟云学术

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ChemPlot, a Python Library for Chemical Space Visualization**

Published:2022-05-19 Issue:7 Volume:2 Page:
ISSN:2628-9725
Container-title:Chemistry–Methods
language:en
Short-container-title:Chemistry Methods

Author:

Cihan Sorkun Murat¹²³^ORCID,Mullaj Dajt¹²,Koelman J. M. Vianney A.¹²³,Er Süleyman¹²^ORCID

Affiliation:

1. DIFFER – Dutch Institute for Fundamental Energy Research De Zaale 20 Eindhoven 5612 AJ the Netherlands

2. CCER – Center for Computational Energy Research De Zaale 20 Eindhoven 5612 AJ the Netherlands

3. Department of Applied Physics Eindhoven University of Technology Eindhoven 5600 MB the Netherlands

Funder

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

Publisher

Wiley

Subject

Materials Science (miscellaneous)

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/cmtd.202200005

Reference43 articles.

1. RDKit: Cheminformatics and Machine Learning Software 2013.

2. PaDEL-descriptor: An open source software to calculate molecular descriptors and fingerprints

3. Mordred: a molecular descriptor calculator

4. Principal component analysis

5. The self-organizing map

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