AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials
Measurement(s) molecular physical property analysis objective Technology Type(s) Computer Modeling
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2022-04-01
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| Series: | Scientific Data |
| Online Access: | https://doi.org/10.1038/s41597-022-01261-1 |
| _version_ | 1819025783210901504 |
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| author | Silvia Gervasoni Giuliano Malloci Andrea Bosin Attilio V. Vargiu Helen I. Zgurskaya Paolo Ruggerone |
| author_facet | Silvia Gervasoni Giuliano Malloci Andrea Bosin Attilio V. Vargiu Helen I. Zgurskaya Paolo Ruggerone |
| author_sort | Silvia Gervasoni |
| collection | DOAJ |
| description | Measurement(s) molecular physical property analysis objective Technology Type(s) Computer Modeling |
| first_indexed | 2024-12-21T05:16:10Z |
| format | Article |
| id | doaj.art-c60297b5a8cc4382882c3b150273e333 |
| institution | Directory Open Access Journal |
| issn | 2052-4463 |
| language | English |
| last_indexed | 2024-12-21T05:16:10Z |
| publishDate | 2022-04-01 |
| publisher | Nature Portfolio |
| record_format | Article |
| series | Scientific Data |
| spelling | doaj.art-c60297b5a8cc4382882c3b150273e3332022-12-21T19:14:55ZengNature PortfolioScientific Data2052-44632022-04-019111210.1038/s41597-022-01261-1AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of AntimicrobialsSilvia Gervasoni0Giuliano Malloci1Andrea Bosin2Attilio V. Vargiu3Helen I. Zgurskaya4Paolo Ruggerone5University of Cagliari, Department of PhysicsUniversity of Cagliari, Department of PhysicsUniversity of Cagliari, Department of PhysicsUniversity of Cagliari, Department of PhysicsUniversity of Oklahoma, Department of Chemistry and BiochemistryUniversity of Cagliari, Department of PhysicsMeasurement(s) molecular physical property analysis objective Technology Type(s) Computer Modelinghttps://doi.org/10.1038/s41597-022-01261-1 |
| spellingShingle | Silvia Gervasoni Giuliano Malloci Andrea Bosin Attilio V. Vargiu Helen I. Zgurskaya Paolo Ruggerone AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials Scientific Data |
| title | AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials |
| title_full | AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials |
| title_fullStr | AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials |
| title_full_unstemmed | AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials |
| title_short | AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials |
| title_sort | ab db force field parameters md trajectories qm based data and descriptors of antimicrobials |
| url | https://doi.org/10.1038/s41597-022-01261-1 |
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