Daria Kokh
Daria Kokh
HITS gGmbH
Verified email at h-its.org
TitleCited byYear
Docking of ubiquitin to gold nanoparticles
G Brancolini, DB Kokh, L Calzolai, RC Wade, S Corni
ACS nano 6 (11), 9863-9878, 2012
992012
Protein binding pocket dynamics
A Stank, DB Kokh, JC Fuller, RC Wade
Accounts of chemical research 49 (5), 809-815, 2016
962016
Modeling and simulation of protein–surface interactions: achievements and challenges
M Ozboyaci, DB Kokh, S Corni, RC Wade
Quarterly reviews of biophysics 49, 2016
802016
On the ultraviolet photofragmentation of hydrogen iodide
AB Alekseyev, HP Liebermann, DB Kokh, RJ Buenker
The Journal of Chemical Physics 113 (15), 6174-6185, 2000
762000
Kinetics for drug discovery: an industry-driven effort to target drug residence time
DA Schuetz, WEA de Witte, YC Wong, B Knasmueller, L Richter, DB Kokh, ...
Drug discovery today 22 (6), 896-911, 2017
752017
Protein–surface interactions: challenging experiments and computations
O Cohavi, S Corni, F De Rienzo, R Di Felice, KE Gottschalk, M Hoefling, ...
Journal of Molecular Recognition: An Interdisciplinary Journal 23 (3), 259-262, 2010
702010
ProMetCS: An atomistic force field for modeling protein− metal surface interactions in a continuum aqueous solvent
DB Kokh, S Corni, PJ Winn, M Hoefling, KE Gottschalk, RC Wade
Journal of chemical theory and computation 6 (5), 1753-1768, 2010
572010
Flexible side chain models improve enrichment rates in in silico screening
DB Kokh, W Wenzel
Journal of medicinal chemistry 51 (19), 5919-5931, 2008
562008
New approaches for computing ligand–receptor binding kinetics
NJ Bruce, GK Ganotra, DB Kokh, SK Sadiq, RC Wade
Current opinion in structural biology 49, 1-10, 2018
532018
Theapproach-induced'I2 (E0+ g↔ I2 (X) D0+ u) transition
ME Akopyan, NK Bibinov, DB Kokh, AM Pravilov, MB Stepanov, ...
Chemical physics 242 (2), 263-272, 1999
481999
TRAPP: A Tool for Analysis of Transient Binding Pockets in Proteins
DB Kokh, S Richter, S Henrich, P Czodrowski, F Rippmann, RC Wade
Journal of chemical information and modeling 53 (5), 1235-1252, 2013
462013
A comparative study of the electron distribution function in the positive columns in and/He dc glow discharges by optical spectroscopy and probes
NK Bibinov, DB Kokh, NB Kolokolov, VA Kostenko, D Meyer, ...
Plasma Sources Science and Technology 7 (3), 298, 1998
441998
Estimation of drug-target residence times by τ-random acceleration molecular dynamics simulations
DB Kokh, M Amaral, J Bomke, U Grädler, D Musil, HP Buchstaller, ...
Journal of chemical theory and computation 14 (7), 3859-3869, 2018
422018
Protein conformational flexibility modulates kinetics and thermodynamics of drug binding
M Amaral, DB Kokh, J Bomke, A Wegener, HP Buchstaller, ...
Nature communications 8 (1), 1-14, 2017
422017
Receptor flexibility in small‐molecule docking calculations
DB Kokh, RC Wade, W Wenzel
Wiley Interdisciplinary Reviews: Computational Molecular Science 1 (2), 298-314, 2011
422011
Ab initio study of spectroscopic and radiative characteristics of ion-pair states of the molecule
DB Kokh, AB Alekseyev, RJ Buenker
The Journal of Chemical Physics 115 (20), 9298-9310, 2001
402001
A Quantitative, Real‐Time Assessment of Binding of Peptides and Proteins to Gold Surfaces
O Cohavi, D Reichmann, R Abramovich, AB Tesler, G Bellapadrona, ...
Chemistry–A European Journal 17 (4), 1327-1336, 2011
362011
Absolute calibration of the efficiency of a VUV-monochromator/detector system in the range 110-450 nm
NK Bibinov, DO Bolshukhin, DB Kokh, AM Pravilov, IP Vinogradov, ...
Measurement Science and Technology 8 (7), 773, 1997
361997
SDA 7: A modular and parallel implementation of the simulation of diffusional association software
M Martinez, NJ Bruce, J Romanowska, DB Kokh, M Ozboyaci, X Yu, ...
Journal of computational chemistry 36 (21), 1631-1645, 2015
352015
Theoretical study of the UV photodissociation of Potentials, transition moments, extinction coefficients, and Cl*/Cl branching ratio
DB Kokh, AB Alekseyev, RJ Buenker
The Journal of chemical physics 120 (24), 11549-11556, 2004
332004
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Articles 1–20