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2023
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TUM School of Computation, Information and Technology
Simulation von Nanosystemen für Energiewandlungen (Prof. Gagliardi)
10.1002/chem.202302375
Title:
Application of Machine Learning Algorithms to Metadynamics for the Elucidation of the Binding Modes and Free Energy Landscape of Drug/Target Interactions: a Case Study
Document type:
Zeitschriftenaufsatz
Author(s):
Siddiqui, Gohar Ali; Stebani, Julia A.; Wragg, Darren; Koutsourelakis, Phaedon‐Stelios; Casini, Angela; Gagliardi, Alessio
Journal title:
Chemistry – A European Journal
Year:
2023
Journal volume:
29
Journal issue:
62
Fulltext / DOI:
doi:10.1002/chem.202302375
Publisher:
Wiley
E-ISSN:
0947-65391521-3765
Date of publication:
28.09.2023
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TUM School of Computation, Information and Technology
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Electrical Engineering
Simulation von Nanosystemen für Energiewandlungen (Prof. Gagliardi)
2023
mediaTUM Gesamtbestand
Hochschulbibliographie
2023
Schools und Fakultäten
TUM School of Computation, Information and Technology
Simulation von Nanosystemen für Energiewandlungen (Prof. Gagliardi)