Suivre
Jun Zhang
Jun Zhang
Department of Mathematics and Computer Sciences, Free University of Berlin
Adresse e-mail validée de fu-berlin.de
Titre
Citée par
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Année
From thermodynamics to kinetics: Enhanced sampling of rare events
L Yang, CW Liu, Q Shao, J Zhang, YQ Gao
Accounts of chemical research 48 (4), 947-955, 2015
632015
Tautomerization-dependent recognition and excision of oxidation damage in base-excision DNA repair
C Zhu, L Lu, J Zhang, Z Yue, J Song, S Zong, M Liu, O Stovicek, YQ Gao, ...
Proceedings of the National Academy of Sciences 113 (28), 7792-7797, 2016
622016
Direct Oxidation of Aliphatic C–H Bonds in Amino-Containing Molecules under Transition-Metal-Free Conditions
X Li, X Che, GH Chen, J Zhang, JL Yan, YF Zhang, LS Zhang, CP Hsu, ...
Organic letters 18 (6), 1234-1237, 2016
422016
Efficient sampling over rough energy landscapes with high barriers: A combination of metadynamics with integrated tempering sampling
YI Yang, J Zhang, X Che, L Yang, YQ Gao
The Journal of Chemical Physics 144 (9), 2016
352016
Dynamics and kinetics study of “In-Water” chemical reactions by enhanced sampling of reactive trajectories
J Zhang, YI Yang, L Yang, YQ Gao
The Journal of Physical Chemistry B 119 (45), 14505-14514, 2015
282015
DNA structural correlation in short and long ranges
C Gu, J Zhang, YI Yang, X Chen, H Ge, Y Sun, X Su, L Yang, S Xie, ...
The Journal of Physical Chemistry B 119 (44), 13980-13990, 2015
232015
Conformational preadjustment in aqueous claisen rearrangement revealed by SITS-QM/MM MD simulations
J Zhang, YI Yang, L Yang, YQ Gao
The Journal of Physical Chemistry B 119 (17), 5518-5530, 2015
222015
Rich dynamics underlying solution reactions revealed by sampling and data mining of reactive trajectories
J Zhang, Z Zhang, YI Yang, S Liu, L Yang, YQ Gao
ACS central science 3 (5), 407-414, 2017
202017
Single mutations reshape the structural correlation network of the DMXAA–human STING complex
X Che, XX Du, X Cai, J Zhang, WJ Xie, Z Long, ZY Ye, H Zhang, L Yang, ...
The Journal of Physical Chemistry B 121 (9), 2073-2082, 2017
162017
Structural flexibility and conformation features of cyclic dinucleotides in aqueous solutions
X Che, J Zhang, Y Zhu, L Yang, H Quan, YQ Gao
The Journal of Physical Chemistry B 120 (10), 2670-2680, 2016
122016
Structural Characteristics of Homogeneous Hydrophobic Ionic Liquid–HNO3–H2O Ternary System: Experimental Studies and Molecular Dynamics Simulations
J Fu, YI Yang, J Zhang, Q Chen, X Shen, YQ Gao
The Journal of Physical Chemistry B 120 (23), 5194-5202, 2016
102016
Simulation studies of protein and small molecule interactions and reaction
L Yang, J Zhang, X Che, YQ Gao
Methods in Enzymology 578, 169-212, 2016
42016
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