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PubPharm (46)
1
Tautomer-specific deacylation and Ω-loop flexibility explain carbapenem-hydrolyzing, broad-spectrum activity of the KPC-2 β-lactamase
enthalten in:
bioRxiv.org
| 2024
von
Tooke, C.
|
Hinchliffe, P.
|
Beer, M.
| +5
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2
Activation and friction in enzymatic loop opening and closing dynamics
enthalten in:
Nature communications
| 2024
von
Zinovjev, K.
|
Guénon, P.
|
Ramos-Guzmán, C.
| +3
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3
emle-engine: a flexible electrostatic machine learning embedding package for multiscale molecular dynamics simulations
enthalten in:
chemRxiv.org
| 2024
von
Zinovjev, K.
|
Hedges, L.
|
Montagud Andreu, R.
| +3
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4
emle-engine: a flexible electrostatic machine learning embedding package for multiscale molecular dynamics simulations
enthalten in:
chemRxiv.org
| 2024
von
Zinovjev, K.
|
Hedges, L.
|
Montagud Andreu, R.
| +3
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5
4-Thiaproline accelerates the slow folding phase of proteins containing cis prolines in the native state by two orders of magnitude
enthalten in:
Protein science : a publication of the Protein Society
| 2024
von
Loughlin, J.
|
Zinovjev, K.
|
Napolitano, S.
| +2
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6
Free energy along drug-protein binding pathways interactively sampled in virtual reality
enthalten in:
arXiv.org
| 2023
von
Deeks, H.
|
Zinovjev, K.
|
Barnoud, J.
| +3
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7
Conformational Changes and ATP Hydrolysis in Zika Helicase : The Molecular Basis of a Biomolecular Motor Unveiled by Multiscale Simulations
enthalten in:
Journal of the American Chemical Society
| 2023
von
García-Martínez, A.
|
Zinovjev, K.
|
Ruiz-Pernía, J.
| +1
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8
Free energy along drug-protein binding pathways interactively sampled in virtual reality
enthalten in:
Scientific reports
| 2023
von
Deeks, H.
|
Zinovjev, K.
|
Barnoud, J.
| +3
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9
Elucidation of the Active Form and Reaction Mechanism in Human Asparaginase Type III Using Multiscale Simulations
enthalten in:
Journal of chemical information and modeling
| 2023
von
Andjelkovic, M.
|
Zinovjev, K.
|
Ramos-Guzmán, C.
| +2
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10
Conformational Changes and ATP Hydrolysis in Zika Helicase. The Molecular Basis of a Biomolecular Motor Unveiled by Multiscale Simulations
enthalten in:
chemRxiv.org
| 2023
von
García-Martínez, A.
|
Zinovjev, K.
|
Ruiz-Pernía, J.
| +1
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540
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10
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059QF0KO0R
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570
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transition state theory
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147336-22-9
1
4-thiaproline
1
530
1
7006-34-0
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7LP2MPO46S
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8L70Q75FXE
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9007-49-2
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96282-35-8
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Erscheinungszeitraum
25
2020-
21
2010-2019
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43
Englisch
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