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1 . Academic Journal
Indolin-2-one derivatives as selective Aurora B kinase inhibitors targeting breast cancer
저자
by
Dokla, Eman M.E.
;
Abdel-Aziz, Amal Kamal
;
Milik, Sandra N.
;
Mahmoud, Amr H.
;
Saadeldin, Mona Kamal
, et al.
소스
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Bioorganic Chemistry
December 2021 117
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7 . Report
Accurate Free Energy Estimations of Molecular Systems Via Flow-based Targeted Free Energy Perturbation
저자
by
Lee, Soo Jung
;
Mahmoud, Amr H.
;
Lill, Markus A.
.
소스
Open Access (Arxiv)
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5 . Academic Journal
A highly selective structure-based virtual screening model of Palm I allosteric inhibitors of HCV Ns5b polymerase enzyme and its application in the discovery and optimization of new analogues
저자
by
Mahmoud, Amr H.
;
Abou El Ella, Dalal A.
;
Ismail, Mohamed A.H.
;
Abouzid, Khaled A.M.
.
소스
In
European Journal of Medicinal Chemistry
November 2012 57:468-482
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6 . Academic Journal
Integrated structure-based activity prediction model of benzothiadiazines on various genotypes of HCV NS5b polymerase (1a, 1b and 4) and its application in the discovery of new derivatives
저자
by
Ismail, Mohamed A.H.
;
Abou El Ella, Dalal A.
;
Abouzid, Khaled A.M.
;
Mahmoud, Amr H.
.
소스
In
Bioorganic & Medicinal Chemistry
1 April 2012 20(7):2455-2478
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6 . Report
Graph-convolution neural network-based flexible docking utilizing coarse-grained distance matrix
저자
by
Mahmoud, Amr H.
;
Lill, Jonas F.
;
Lill, Markus A.
.
소스
Open Access (Arxiv)
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5 . Academic Journal
Synthesis, binding studies and molecular modeling of novel cannabinoid receptor ligands
저자
by
Osman, Noha A.
;
Mahmoud, Amr H.
;
Allarà, Marco
;
Niess, Raimund
;
Abouzid, Khaled A.
, et al.
소스
In
Bioorganic & Medicinal Chemistry
2010 18(24):8463-8477
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7 . Report
On-the-fly Prediction of Protein Hydration Densities and Free Energies using Deep Learning
저자
by
Ghanbarpour, Ahmadreza
;
Mahmoud, Amr H.
;
Lill, Markus A.
.
소스
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5 . Academic Journal
Deep Learning Model for Efficient Protein–Ligand Docking with Implicit Side-Chain Flexibility.
저자
by
Masters, Matthew R.
;
Mahmoud, Amr H.
;
Wei, Yao
;
Lill, Markus A.
.
소스
Journal of Chemical Information & Modeling; 3/27/2023, Vol. 63 Issue 6, p1695-1707, 13p
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6 . Academic Journal
Efficient virtual high-content screening using a distance-aware transformer model
저자
by
Sellner, Manuel S.
;
Mahmoud, Amr H.
;
Lill, Markus A.
.
소스
Journal of Cheminformatics
. 15(1)
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5 . Academic Journal
Rubiscolins are naturally occurring G protein-biased delta opioid receptor peptides
저자
by
Cassell, Robert J.
;
Mores, Kendall L.
;
Zerfas, Breanna L.
;
Mahmoud, Amr H.
;
Lill, Markus A.
, et al.
소스
In
European Neuropsychopharmacology
March 2019 29(3):450-456
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