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Improving virtual screening results with MM/GBSA and MM/PBSA rescoring
Improving virtual screening results with MM/GBSA and MM/PBSA rescoring
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Improving virtual screening results with MM/GBSA and MM/PBSA rescoring

Sahakyan, Harutyun

Journal of computer-aided molecular design, 2021-06, Vol.35 (6), p.731-736 [Periódico revisado por pares]

Cham: Springer International Publishing

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2
A Study of a Protein-Folding Machine: Transient Rotation of the Polypeptide Backbone Facilitates Rapid Folding of Protein Domains in All-Atom Molecular Dynamics Simulations
A Study of a Protein-Folding Machine: Transient Rotation of the Polypeptide Backbone Facilitates Rapid Folding of Protein Domains in All-Atom Molecular Dynamics Simulations
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A Study of a Protein-Folding Machine: Transient Rotation of the Polypeptide Backbone Facilitates Rapid Folding of Protein Domains in All-Atom Molecular Dynamics Simulations

Sahakyan, Harutyun ; Nazaryan, Karen ; Mushegian, Arcady ; Sorokina, Irina

International journal of molecular sciences, 2023-06, Vol.24 (12), p.10049 [Periódico revisado por pares]

Switzerland: MDPI AG

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3
Structural and electrophysiological basis for the modulation of KCNQ1 channel currents by ML277
Structural and electrophysiological basis for the modulation of KCNQ1 channel currents by ML277
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Structural and electrophysiological basis for the modulation of KCNQ1 channel currents by ML277

Willegems, Katrien ; Eldstrom, Jodene ; Kyriakis, Efthimios ; Ataei, Fariba ; Sahakyan, Harutyun ; Dou, Ying ; Russo, Sophia ; Van Petegem, Filip ; Fedida, David

Nature communications, 2022-06, Vol.13 (1), p.3760-3760, Article 3760 [Periódico revisado por pares]

London: Nature Publishing Group

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4
In silico study of colchicine resistance molecular mechanisms caused by tubulin structural polymorphism
In silico study of colchicine resistance molecular mechanisms caused by tubulin structural polymorphism
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In silico study of colchicine resistance molecular mechanisms caused by tubulin structural polymorphism

Sahakyan, Harutyun ; Abelyan, Narek ; Arakelov, Vahram ; Arakelov, Grigor ; Nazaryan, Karen Levy, Yaakov Koby

PloS one, 2019-08, Vol.14 (8), p.e0221532-e0221532 [Periódico revisado por pares]

United States: Public Library of Science

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5
CoCoNuTs are a diverse subclass of Type IV restriction systems predicted to target RNA
CoCoNuTs are a diverse subclass of Type IV restriction systems predicted to target RNA
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CoCoNuTs are a diverse subclass of Type IV restriction systems predicted to target RNA

Bell, Ryan T ; Sahakyan, Harutyun ; Makarova, Kira S ; Wolf, Yuri I ; Koonin, Eugene V

eLife, 2024-05, Vol.13 [Periódico revisado por pares]

England: eLife Science Publications, Ltd

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6
A generic binding pocket for small molecule IKs activators at the extracellular inter-subunit interface of KCNQ1 and KCNE1 channel complexes
A generic binding pocket for small molecule IKs activators at the extracellular inter-subunit interface of KCNQ1 and KCNE1 channel complexes
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A generic binding pocket for small molecule IKs activators at the extracellular inter-subunit interface of KCNQ1 and KCNE1 channel complexes

Chan, Magnus ; Sahakyan, Harutyun ; Eldstrom, Jodene ; Sastre, Daniel ; Wang, Yundi ; Dou, Ying ; Pourrier, Marc ; Vardanyan, Vitya ; Fedida, David

eLife, 2023-09, Vol.12 [Periódico revisado por pares]

Cambridge: eLife Sciences Publications Ltd

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7
Identification of non-classical hCA XII inhibitors using combination of computational approaches for drug design and discovery
Identification of non-classical hCA XII inhibitors using combination of computational approaches for drug design and discovery
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Identification of non-classical hCA XII inhibitors using combination of computational approaches for drug design and discovery

Al-Sanea, Mohammad M ; Chilingaryan, Garri ; Abelyan, Narek ; Arakelov, Grigor ; Sahakyan, Harutyun ; Arakelov, Vahram G ; Nazaryan, Karen ; Hussein, Shaimaa ; Alazmi, Gharam M ; Alsharari, Haifa E ; Al-Faraj, Waad M ; Alruwaili, Faten S ; Albilasi, Nouf Q ; Alsharari, Tahani S ; Alsaleh, Abdulaziz A S ; Alazmi, Turki M ; Almalki, Atiah H ; Alotaibi, Nasser H ; Abdelgawad, Mohamed A

Scientific reports, 2021-07, Vol.11 (1), p.15516-15516, Article 15516 [Periódico revisado por pares]

England: Nature Publishing Group

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8
Energy-dependent protein folding: modeling how a protein folding machine may work [version 1; peer review: 1 approved, 3 approved with reservations]
Energy-dependent protein folding: modeling how a protein folding machine may work [version 1; peer review: 1 approved, 3 approved with reservations]
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Energy-dependent protein folding: modeling how a protein folding machine may work [version 1; peer review: 1 approved, 3 approved with reservations]

Sahakyan, Harutyun ; Nazaryan, Karen ; Mushegian, Arcady ; Sorokina, Irina

F1000 research, 2021, Vol.10, p.3-3 [Periódico revisado por pares]

England: Faculty of 1000 Ltd

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9
Synthesis, Antitumor Activity, and Docking Analysis of New Pyrido[3',2':4,5]furo(thieno)[3,2- d ]pyrimidin-8-amines
Synthesis, Antitumor Activity, and Docking Analysis of New Pyrido[3',2':4,5]furo(thieno)[3,2- d ]pyrimidin-8-amines
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Synthesis, Antitumor Activity, and Docking Analysis of New Pyrido[3',2':4,5]furo(thieno)[3,2- d ]pyrimidin-8-amines

Sirakanyan, Samvel N ; Spinelli, Domenico ; Geronikaki, Athina ; Hakobyan, Elmira K ; Sahakyan, Harutyun ; Arabyan, Erik ; Zakaryan, Hovakim ; Nersesyan, Lusine E ; Aharonyan, Anahit S ; Danielyan, Irina S ; Muradyan, Rafayel E ; Hovakimyan, Anush A

Molecules (Basel, Switzerland), 2019-10, Vol.24 (21), p.3952 [Periódico revisado por pares]

Switzerland: MDPI AG

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10
A new microtubule-stabilizing agent shows potent antiviral effects against African swine fever virus with no cytotoxicity
A new microtubule-stabilizing agent shows potent antiviral effects against African swine fever virus with no cytotoxicity
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A new microtubule-stabilizing agent shows potent antiviral effects against African swine fever virus with no cytotoxicity

Sirakanyan, Samvel ; Arabyan, Erik ; Hakobyan, Astghik ; Hakobyan, Tamara ; Chilingaryan, Garri ; Sahakyan, Harutyun ; Sargsyan, Arsen ; Arakelov, Grigor ; Nazaryan, Karen ; Izmailyan, Roza ; Abroyan, Liana ; Karalyan, Zaven ; Arakelova, Elina ; Hakobyan, Elmira ; Hovakimyan, Anush ; Serobian, Andre ; Neves, Marco ; Ferreira, João ; Ferreira, Fernando ; Zakaryan, Hovakim

Emerging microbes & infections, 2021-01, Vol.10 (1), p.783-796 [Periódico revisado por pares]

United States: Taylor & Francis

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