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journalStr:"Molecular diversity"
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PubPharm (559)
1
Fragment-based discovery of new potential DNMT1 inhibitors integrating multiple pharmacophore modeling, 3D-QSAR, virtual screening, molecular docking, ADME, and molecular dynamics simulation approaches
enthalten in:
Molecular diversity
| 2024
von
Lanka, G.
|
Banerjee, S.
|
Adhikari, N.
| +1
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2
Design, synthesis and herbicidal activity of novel cyclohexanedione derivations containing pyrazole and pyridine groups as potential HPPD inhibitors
enthalten in:
Molecular diversity
| 2024
von
Hou, S.
|
Han, L.
|
Li, W.
| +5
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3
Unraveling the anti-breast cancer activity of Cimicifugae rhizoma using biological network pathways and molecular dynamics simulation
enthalten in:
Molecular diversity
| 2024
von
Sinha, P.
|
Yadav, A.
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4
In silico study to identify novel NEK7 inhibitors from natural sources by a combination strategy
enthalten in:
Molecular diversity
| 2024
von
Zhang, H.
|
Lu, C.
|
Yao, Q.
| +1
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5
Network pharmacology combined with molecular docking and dynamics to assess the synergism of esculetin and phloretin against acute kidney injury-diabetes comorbidity
enthalten in:
Molecular diversity
| 2024
von
Dagar, N.
|
Jadhav, H.
|
Gaikwad, A.
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6
Structure-based inhibition of acetylcholinesterase and butyrylcholinesterase with 2-Aryl-6-carboxamide benzoxazole derivatives : synthesis, enzymatic assay, and in silico studies
enthalten in:
Molecular diversity
| 2024
von
Kuzu, B.
|
Alagoz, M.
|
Demir, Y.
| +3
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7
Exploring host epigenetic enzymes as targeted therapies for visceral leishmaniasis : in silico design and in vitro efficacy of KDM6B and ASH1L inhibitors
enthalten in:
Molecular diversity
| 2024
von
Dutta, M.
|
Qamar, T.
|
Kushavah, U.
| +2
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8
Network pharmacology, molecular docking, and molecular dynamics simulation analysis reveal the molecular mechanism of halociline against gastric cancer
enthalten in:
Molecular diversity
| 2024
von
Zha, X.
|
Ji, R.
|
Li, Y.
| +2
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9
Deciphering the multi-functional role of Indian propolis for the management of Alzheimer's disease by integrating LC-MS/MS, network pharmacology, molecular docking, and in-vitro studies
enthalten in:
Molecular diversity
| 2024
von
Sankaran, S.
|
Dubey, R.
|
Gomatam, A.
| +3
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10
First report on chemometrics-driven multilayered lead prioritization in addressing oxysterol-mediated overexpression of G protein-coupled receptor 183
enthalten in:
Molecular diversity
| 2024
von
Bhattacharjee, A.
|
Kar, S.
|
Ojha, P.
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Zeitschrift: Molecular diversity
Medienart
559
Aufsätze
442
E-Artikel
442
E-Ressourcen
117
Gedruckte Aufsätze
Zeitschriftentitel
Molecular diversity
Thema
531
Molecular docking
205
Journal Article
55
Virtual screening
50
COVID-19
46
Network pharmacology
38
SARS-CoV-2
36
3D-QSAR
36
Molecular dynamics
32
Molecular dynamics simulation
24
Anticancer activity
23
Molecular dynamics simulations
23
Synthesis
19
CoMFA
18
Cytotoxicity
18
MD simulation
17
Ligands
16
Antineoplastic Agents
16
Pharmacophore modeling
15
Antiviral Agents
15
Pharmacophore
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Erscheinungszeitraum
429
2020-
124
2010-2019
6
2000-2009
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Sprache
559
Englisch
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