Biophysical Chemistry
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- 2018
-
Mark
Prediction of binding poses to FXR using multi-targeted docking combined with molecular dynamics and enhanced sampling
- Contribution to journal › Article
-
Mark
Compressibility of the protein-water interface
- Contribution to journal › Article
-
Mark
How proteins modify water dynamics
- Contribution to journal › Article
-
Mark
The geometry of protein hydration
- Contribution to journal › Article
-
Mark
The spatial range of protein hydration
- Contribution to journal › Article
- 2017
-
Mark
Resolving the problem of trapped water in binding cavities : prediction of host–guest binding free energies in the SAMPL5 challenge by funnel metadynamics
- Contribution to journal › Article
-
Mark
Site-selective 13C labeling of proteins using erythrose
- Contribution to journal › Article
-
Mark
The Dynameomics Entropy Dictionary : A Large-Scale Assessment of Conformational Entropy across Protein Fold Space
Towse, Clare Louise ; Akke, Mikael LU
and Daggett, Valerie
(2017)
In Journal of Physical Chemistry B
121(16).
p.3933-3945
- Contribution to journal › Article
-
Mark
Dynamics of Aromatic Side Chains in the Active Site of FKBP12
Weininger, Ulrich LU ; Modig, Kristofer LU
; Geitner, Anne Juliane
; Schmidpeter, Philipp A.M.
; Koch, Johanna R.
and Akke, Mikael
LU
(2017)
In Biochemistry
56(1).
p.334-343
- Contribution to journal › Article
-
Mark
Structural model of dodecameric heat-shock protein Hsp21 : Flexible N-terminal arms interact with client proteins while C-terminal tails maintain the dodecamer and chaperone activity
Rutsdottir, Gudrun LU ; Härmark, Johan ; Weide, Yoran LU ; Hebert, Hans LU ; Ib Rasmussen, Morten ; Wernersson, Sven LU ; Respondek, Michal LU ; Akke, Mikael LU
; Højrup, Peter
and Koeck, Philip J B
, et al.
(2017)
In Journal of Biological Chemistry
292(19).
p.8103-8121
- Contribution to journal › Article