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Journal of Physical Chemistry B cover

Journal of Physical Chemistry B

IF2.9
Papers1436
Citations90487
Journal Papers 1205
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Conformational Dynamics of Plasmepsin X during Inhibitor Binding
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deleteKarubiu, Wilson; Kullmann, Richard; Krummhaar, Michael; Roth, Christian; Weikl, Thomas R.
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Role of Entropy in Hydrogen Abstraction by tert-Butoxy Radicals: A Quantum Chemistry and Continuum Solvation Study
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deleteBatalha de Souza, Gabriel; Fournet, Rene; Paes, Francisco; Citrangolo Destro, Fabiola; Glaude, Pierre-Alexandre; Sirjean, Baptiste
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Tautomerism in 1-Pyridin-2-yl-1H-pyrazol-5-ols through the Prism of Molecular Switching: The Rare Case of OH/CH Switching upon Acidic Input
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deleteAntonov, Liudmil; Zaharieva, Lidia; Vassilev, Nikolay; Deneva, Vera; Angelov, Ivan
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An Immuno-Infrared Sensor Detects Preclinical Alzheimer's and Parkinson's Disease by Protein Misfolding
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deleteGerwert, Grischa; Mann, Marvin; Langenhoff, Lennart; Woitzik, Nathalie; Hubert, Diana; Duman, Deniz; Hoveler, Adrian; Budde, Sandy; Simon, Jonas; Beyer, Leon; Schuler, Martin; Weber, Sandrina; Mollenhauer, Brit; Kotting, Carsten; Guldenhaupt, Jorn; Gerwert, Klaus
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Predicting Absorption and Diffusion of Plasma-Generated O(3P), O(1D), and Other RONS in Aqueous Environments Using Molecular Simulations
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deleteSaji, Tijin H. G.; Vlugt, Thijs J. H.; Calero, Sofia; Bagheri, Behnaz
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Regulatory Mechanism of Ionic Liquids on the Structure and Molecular Weight of the Melamine-Formaldehyde Prepolymer: Experimental and Theoretical Insights
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deleteWang, Chenguang; Tian, Jing; Sun, Yikai; Yang, Chunyu; Zhang, Hao; Gao, Hongshuai; Nie, Yi
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Kinetics of CO2 Adsorption and Deformation in Microporous Carbon: A Classical DFT Approach
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deleteKolesnikov, Andrei L.; Arifian, Yosef Benedikt A.; Lange, Marcus; Mollmer, Jens
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Molecular Simulations of Phase Separation in Elastic Polymer Networks
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deleteYokoyama, Takahiro; Qiang, Yicheng; Zwicker, David; Nikoubashman, Arash
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Novel Capillary Effect in a Curled Open Capillary Tube
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deleteHan, Yekun; Zhang, Bo; Zhang, Yongwang; Peng, Zhilong; Gao, Xinghua; Liu, Ming; Chen, Shaohua
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pH-Driven Distinct Aggregation Pathways of Human γD-Crystallin
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deleteIndu; Mishra, Rajesh
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Thermally Induced Conformation Remodeling Remarkably Boosts Cytochrome c Activity
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deleteLiu, Si; Zhang, Yukun; Sun, Yan; Dong, Xiaoyan
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Multiscale Simulations Reveal Distal Allosteric Reprogramming of Pocket Dynamics and Dual Hydrolytic Pathways in Engineered Methyl Parathion Hydrolase
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deleteLiu, Xiaoyuan; Fu, Yuzhuang; Yu, Jun; Lv, Nan; Zhang, Zhiyang; Zhao, Yuan; Si, Yubing; Cao, Zexing
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Atomistic Insights into Conformations and Solvation Dynamics of Amylose, Dextran, and Pullulan Using Three Force Fields
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deleteFarzeen, Parisa; Yoon, Hu Young; Coutinho, Isabela Trindade; Roman, Maren; Moore, Robert; Deshmukh, Sanket A.
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Free-Energy Calculations of Biomolecular Processes: Methods Development, Benchmarking, and Applications
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deleteCournia, Zoe; Chipot, Christophe
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Cannabidiol (CBD) Induces Lipid Microdomain Disruption or Budding in Ternary Mixtures
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deleteVelez-Saboya, C. S.; Lopez-Perez, Francisco A.; Rodriguez-Huerta, Luis G.; Sierra-Valdez, Francisco J.; Romero-Arias, J. Roberto; Barrio, R. A.; Ruiz-Suarez, J. C.
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DNA Target Search in Chromatin Compartments under Stochastic Resetting
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deleteJangid, Pankaj; Chaudhury, Srabanti
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Covalent Grafting of Low-k Magnolol Films on Si(111) Using Aryldiazonium Salts
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deleteCao, Liang; Rong, Yaohui; Xu, Dan; Tian, Xindan; Chen, En; Gong, Maogao; Xia, Junsheng; Guo, Xiaohui
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Classical Density Functional Treatment of Polydisperse Polarizable Clusters
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deleteWoodward, Clifford E.; Ribar, David; Forsman, Jan
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Molecular Signatures of Pressure-Induced Phase Transitions in a Lipid Bilayer
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deleteGautier, Yanna; Stirnemann, Guillaume; Henin, Jerome
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Exploring Structural Perturbations Caused by Cancer-Related Mutations in Pyruvate Kinase M2: A Comparison with the Wild-Type Enzyme
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deleteMitra, Anandita; Paul, Sandip
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