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/vufind/Search/Results?lookfor=%22Virtual+screening%22&type=Subject&sort=year%2C+publishDateDaySort_date+desc%2C+id
/vufind/Search/Results?lookfor=%22Virtual+screening%22&type=Subject&sort=year%2C+publishDateDaySort_date+desc%2C+id
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PubPharm (7.911)
1
Identifying novel aryl hydrocarbon receptor (AhR) modulators from clinically approved drugs : In silico screening and In vitro validation
enthalten in:
Archives of biochemistry and biophysics
| 2024
von
Mosa, F.
|
Alqahtani, M.
|
El-Ghiaty, M.
| +2
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2
Predictive insights into plant-based compounds as fibroblast growth factor receptor 1 inhibitors : a combined molecular docking and dynamics simulation study
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Almoyad, M.
|
Wahab, S.
|
Ansari, M.
| +3
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3
Identification and assessment of new PIM2 inhibitors for treating hematologic cancers : A combined approach of energy-based virtual screening and machine learning evaluation
enthalten in:
Archiv der Pharmazie
| 2024
von
Chen, X.
|
Zhao, J.
|
Chen, R.
| +12
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4
In silico study of androgen receptor N-terminal domain and exploration of its modulators
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Zhang, W.
|
Hu, H.
|
Zhu, Y.
| +4
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5
Integrated machine learning-based virtual screening and biological evaluation for identification of potential inhibitors against cathepsin K
enthalten in:
Molecular diversity
| 2024
von
Parwez, S.
|
Chaurasia, A.
|
Mahapatra, P.
| +2
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6
Deep Learning-Based construction of a Drug-Like compound database and its application in virtual screening of HsDHODH inhibitors
enthalten in:
Methods (San Diego, Calif.)
| 2024
von
Xia, W.
|
Xiao, J.
|
Bian, H.
| +3
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7
Structural insights into the potential binding sites of Cathepsin D using molecular modelling techniques
enthalten in:
Amino acids
| 2024
von
Kamble, S.
|
Barale, S.
|
Mohammed, A.
| +3
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8
Structural insights into the potential binding sites of Cathepsin D using molecular modelling techniques
enthalten in:
Amino acids
| 2024
von
Kamble, S.
|
Barale, S.
|
Mohammed, A.
| +3
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9
In silico identification of phytochemical inhibitors for multidrug-resistant tuberculosis based on novel pharmacophore generation and molecular dynamics simulation studies
enthalten in:
BMC chemistry
| 2024
von
Alotaibi, B.
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10
The present state and challenges of active learning in drug discovery
enthalten in:
Drug discovery today
| 2024
von
Wang, L.
|
Zhou, Z.
|
Yang, X.
| +3
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7.901
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Journal of computer aided molecular design
504
Journal of biomolecular structure & dynamics
352
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240
Molecules (Basel, Switzerland)
234
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232
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180
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110
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91
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85
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83
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77
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73
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73
Frontiers in pharmacology
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4.111
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3.439
Virtual screening
2.885
virtual screening
1.153
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857
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740
molecular docking
711
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558
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470
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355
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352
molecular dynamics
338
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328
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315
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311
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298
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285
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276
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266
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264
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