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/vufind/Search/Results?lookfor=%22molecular+modeling%22&type=Subject&filter%5B%5D=topic_facet%3A%22Ligands%22
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PubPharm (358)
1
The Adipokinetic Hormone (AKH) and the Adipokinetic Hormone/Corazonin-Related Peptide (ACP) Signalling Systems of the Yellow Fever Mosquito Aedes aegypti : Chemical Models of Binding
enthalten in:
Biomolecules
| 2024
von
Jackson, G.
|
Sani, M.
|
Marco, H.
| +2
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2
What is allosteric regulation? Exploring the exceptions that prove the rule!
enthalten in:
The Journal of biological chemistry
| 2024
von
McCullagh, M.
|
Zeczycki, T.
|
Kariyawasam, C.
| +5
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3
The Potential of Usnic-Acid-Based Thiazolo-Thiophenes as Inhibitors of the Main Protease of SARS-CoV-2 Viruses
enthalten in:
Viruses
| 2024
von
Yarovaya, O.
|
Filimonov, A.
|
Baev, D.
| +12
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4
How do physicochemical properties contribute to inhibitory activity of promising peptides against Zika Virus NS3 protease?
enthalten in:
Journal of molecular modeling
| 2024
von
Savino, D.
|
Silva, J.
|
da Silva Santos, S.
| +2
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5
Validating Fractalkine receptor as a target and identifying candidates for drug discovery against type 2 diabetes
enthalten in:
Journal of cellular biochemistry
| 2024
von
Yadav, M.
|
Akhter, Y.
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6
Development of 2-Aminotetralin-Type Serotonin 5-HT1 Agonists : Molecular Determinants for Selective Binding and Signaling at 5-HT1A, 5-HT1B, 5-HT1D, and 5-HT1F Receptors
enthalten in:
ACS chemical neuroscience
| 2024
von
McGlynn, R.
|
Cui, M.
|
Brems, B.
| +2
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7
Characterization of erythroferrone oligomerization and its impact on BMP antagonism
enthalten in:
The Journal of biological chemistry
| 2024
von
Mast, J.
|
Leach, E.
|
Thompson, T.
UpdateOf: bioRxiv. 2023 Sep 02;:. - PMID 37693455
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8
Recent developments in molecular modeling tools and applications related to pharmaceutical and biomedical research
enthalten in:
Journal of pharmaceutical and biomedical analysis
| 2024
von
Peluso, P.
|
Chankvetadze, B.
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9
Molecular Modeling Techniques and In-Silico Drug Discovery
enthalten in:
Methods in molecular biology (Clifton, N.J.)
| 2024
von
Bagchi, A.
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10
Identification of potential death-associated protein kinase-1 (DAPK1) inhibitors by an integrated ligand-based and structure-based computational drug design approach
enthalten in:
Journal of biomolecular structure & dynamics
| 2023
von
Ghosh, P.
|
Singh, R.
|
Ganeshpurkar, A.
| +4
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Thema: Ligands
Medienart
351
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Zeitschriftentitel
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Molecules (Basel, Switzerland)
23
European journal of medicinal chemistry
19
The Journal of biological chemistry
15
International journal of molecular sciences
15
Journal of biomolecular structure & dynamics
14
Journal of molecular graphics & modelling
13
Spectrochimica acta. Part A, Molecular and biom...
11
Bioorganic & medicinal chemistry
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Bioorganic & medicinal chemistry letters
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ChemMedChem
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Methods in molecular biology (Clifton, N.J.)
6
ACS chemical neuroscience
5
Chemistry (Weinheim an der Bergstrasse, Germany)
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Future medicinal chemistry
4
Biochimica et biophysica acta. General subjects
4
Chembiochem : a European journal of chemical bi...
4
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Thema
Ligands
323
Journal Article
131
Research Support, Non-U.S. Gov't
125
molecular modeling
109
Molecular modeling
61
Molecular modelling
32
Proteins
30
Review
29
Research Support, N.I.H., Extramural
24
molecular modelling
19
Receptors, G-Protein-Coupled
19
docking
17
Peptides
17
molecular dynamics
16
drug design
15
Antineoplastic Agents
15
Molecular dynamics
14
Acetylcholinesterase
14
Cholinesterase Inhibitors
14
Coordination Complexes
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Erscheinungszeitraum
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