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PubPharm (74)
1
Mechanism of RGD-conjugated nanodevice binding to its target protein integrin αVβ3 by atomistic molecular dynamics and machine learning
enthalten in:
Nanoscale
| 2024
von
Frigerio, G.
|
Donadoni, E.
|
Siani, P.
| +5
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2
The AhR Signaling Mechanism : A Structural Point of View
enthalten in:
Journal of molecular biology
| 2024
von
Bonati, L.
|
Motta, S.
|
Callea, L.
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3
Aryl hydrocarbon receptor-dependent and -independent pathways mediate curcumin anti-aging effects
enthalten in:
bioRxiv.org
| 2023
von
Brinkmann, V.
|
Romeo, M.
|
Larigot, L.
| +16
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4
Molecular Dynamics for the Optimal Design of Functionalized Nanodevices to Target Folate Receptors on Tumor Cells
enthalten in:
ACS biomaterials science & engineering
| 2023
von
Donadoni, E.
|
Frigerio, G.
|
Siani, P.
| +5
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5
Drug Design in the Exascale Era : A Perspective from Massively Parallel QM/MM Simulations
enthalten in:
Journal of chemical information and modeling
| 2023
von
Raghavan, B.
|
Paulikat, M.
|
Ahmad, K.
| +7
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6
TCDD-Induced Allosteric Perturbation of the AhR:ARNT Binding to DNA
enthalten in:
International journal of molecular sciences
| 2023
von
Motta, S.
|
Bonati, L.
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7
Metadynamics simulations for the investigation of drug loading on functionalized inorganic nanoparticles
enthalten in:
Nanoscale
| 2023
von
Motta, S.
|
Siani, P.
|
Donadoni, E.
| +3
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8
Drug Design in the Exascale Era: A Perspective from Massively Parallel QM/MM Simulations
enthalten in:
chemRxiv.org
| 2023
von
Raghavan, B.
|
Paulikat, M.
|
Ahmad, K.
| +7
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9
Aryl Hydrocarbon Receptor-Dependent and -Independent Pathways Mediate Curcumin Anti-Aging Effects
enthalten in:
Antioxidants (Basel, Switzerland)
| 2022
von
Brinkmann, V.
|
Romeo, M.
|
Larigot, L.
| +16
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10
PathDetect-SOM : A Neural Network Approach for the Identification of Pathways in Ligand Binding Simulations
enthalten in:
Journal of chemical theory and computation
| 2022
von
Motta, S.
|
Callea, L.
|
Bonati, L.
| +1
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Thema
42
Journal Article
23
Ligands
20
Receptors, Aryl Hydrocarbon
16
Research Support, N.I.H., Extramural
15
Research Support, Non-U.S. Gov't
11
Polychlorinated Dibenzodioxins
10
Basic Helix-Loop-Helix Transcription Factors
7
Proteins
6
138391-32-9
6
Aryl Hydrocarbon Receptor Nuclear Translocator
5
Aryl hydrocarbon receptor
4
1B37H0967P
4
Ahr protein, mouse
4
Industrial chemicals
4
Molecular descriptors
4
Molecular docking
4
Review
4
Structural similarity
4
Virtual screening
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aryl hydrocarbon receptor
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Erscheinungszeitraum
66
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4
1900-1999
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Englisch
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