Sdfconf: A Novel, Flexible, and Robust Molecular Data Management Tool-Reference-Cited by-同舟云学术

Sdfconf: A Novel, Flexible, and Robust Molecular Data Management Tool

Published:2021-12-21 Issue:1 Volume:62 Page:9-15
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Lätti Sakari T.¹²³^ORCID,Niinivehmas Sanna¹²³,Pentikäinen Olli T.¹²³^ORCID

Affiliation:

1. Institute of Biomedicine, Faculty of Medicine, University of Turku, FI-20520 Turku, Finland

2. InFLAMES Research Flagship Center, University of Turku, FI-20520 Turku, Finland

3. Aurlide ltd, FI-21420 Lieto, Finland

Funder

Terveyden Tutkimuksen Toimikunta

Turku Drug Research Doctoral Program (DRDP)

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.1c01051

Reference19 articles.

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2. DataWarrior: An Open-Source Program For Chemistry Aware Data Visualization And Analysis

3. ChEMBL: a large-scale bioactivity database for drug discovery

4. The ChEMBL database in 2017

5. OPLS3e: Extending Force Field Coverage for Drug-Like Small Molecules

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