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Refining Ligand Poses in RNA/Ligand Complexes of Pharmaceutical Relevance: A Perspective by QM/MM Simulations and NMR Measurements

; ; ; ; ; ; ; ; ;

In
The journal of physical chemistry letters 16(7), Seiten/Artikel-Nr.:1702-1708

ImpressumWashington, DC : ACS

ISSN1948-7185

Online
DOI: 10.1021/acs.jpclett.4c03456

DOI: 10.18154/RWTH-2025-10098
URL: https://publications.rwth-aachen.de/record/1022546/files/1022546.pdf

Einrichtungen

  1. JARA-BRAIN (080010)
  2. Klinik und Lehrstuhl für Neurologie (535000-2 ; 933810)
  3. Lehrstuhl für Computergestützte molekulare Medizin (FZ Jülich) (531040-4 ; 933320 ; 933310)
  4. Lehrstuhl für Theoretische Biophysik (FZ Jülich) (137810)
  5. Fachgruppe Physik (130000)


Thematische Einordnung (Klassifikation)
DDC: 530

OpenAccess:
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Dokumenttyp
Journal Article

Format
online

Sprache
English

Anmerkung
Peer reviewed article

Externe Identnummern
SCOPUS: SCOPUS:2-s2.0-85217523134
WOS Core Collection: WOS:001417475500001

Interne Identnummern
RWTH-2025-10098
Datensatz-ID: 1022546

Beteiligte Länder
Austria, Germany

Lizenzstatus der Zeitschrift

 GO

Medline ; Creative Commons Attribution CC BY 4.0 ; OpenAccess ; Clarivate Analytics Master Journal List ; Current Contents - Physical, Chemical and Earth Sciences ; Essential Science Indicators ; IF >= 5 ; JCR ; SCOPUS ; Science Citation Index Expanded ; Web of Science Core Collection
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The record appears in these collections:
Document types > Articles > Journal Articles
Faculty of Mathematics and Natural Sciences (Fac.1) > Department of Physics
Publication server / Open Access
Faculty of Medicine (Fac.10)
Central and Other Institutions
531040\-4
535000\-2
Public records
Publications database
080010
130000
137810
 Record created 2025-11-28, last modified 2025-12-02
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