Journal Of Physical Chemistry B

Decoupling Gating and Selectivity in the Mechanosensitive OSCA3.1 Channel: A Free Energy Landscape and Hydration Dynamics Stud

Author: Xiong, Runxi; Zhang, Wenying; Gao, Liming; Zhao, Guodong; Lv, Xianghong; Yuan, Shuai

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 17, pp. 4585-4595. DOI: 10.1021/acs.jpcb.6c00613

Coarse-Grained Models for Simulations of Conformational Properties of Three-Dimensional Ladder Polymers in Solution

Author: Wu, Chaofu

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 17, pp. 4657-4671. DOI: 10.1021/acs.jpcb.6c00033

Regulatory Mechanism of Ionic Liquids on the Structure and Molecular Weight of the Melamine-Formaldehyde Prepolymer: Experimental and Theoretical Insight

Author: Wang, Chenguang; Tian, Jing; Sun, Yikai; Yang, Chunyu; Zhang, Hao; Gao, Hongshuai; Nie, Yi

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 17, pp. 4645-4656. DOI: 10.1021/acs.jpcb.5c07655

Modeling Method Based on Traditional Machine Learning and Graph Neural Network for Interpretable Prediction of Short Peptide log

Author: Li, Jing; Gu, Yutian; Guo, Qianyu; Lai, Rui; Han, Weiwei

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 17, pp. 4624-4635. DOI: 10.1021/acs.jpcb.6c00299

Effect of Ion Specificity on the Interfacial Behavior of Amphiphilic Hyperbranched Copolymer H-P(OEGMA-co-LMA

Author: Wei, Yuqing; Wen, Gangyao; Balafouti, Anastasia; Pispas, Stergios; Sun, Zhaoyan; Li, Hongfei

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 16, pp. 4497-4503. DOI: 10.1021/acs.jpcb.6c00133

Leveraging Zone Annealing to Navigate the Coassembly Pathway of High-Loading Nanorods in Block Copolymers for Enhanced Thermal Transpor

Author: Deng, Yifu; Zhu, Zhepeng; Lin, Jiaping; Zhang, Liangshun

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 16, pp. 4504-4516. DOI: 10.1021/acs.jpcb.6c00394

SRMMP-CharQM, Physics-Informed Deep Learning for Toxicity Prediction: Quantum Mechanical Descriptors Enable Scaffold Hopping in Mitochondrial Membrane Potential Assay

Author: He, Qizheng; Yi, Fengfei; Han, Weiwei

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 16, pp. 4333-4343. DOI: 10.1021/acs.jpcb.6c01087

Enhanced FRET Efficiency and Kinetics Mediated by ESIPT Molecules: Insights from Solvent Regulation and Quantum Dot Compariso

Author: Huang, Zibin; Yin, Hang; Zhao, Xin; Li, Bo; Shi, Ying; Wei, Zhipeng

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 15, pp. 4178-4186. DOI: 10.1021/acs.jpcb.5c08234

Entropy-Driven Protein Allosteric Effect in Cells Highlights the Role of Solvation Water Molecule

Author: Zhang, Xueying; Chen, Xiaoxu; Wang, Mengting; Song, Xiangfei; Wang, Yefei; Yao, Lishan

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 15, pp. 4147-4154. DOI: 10.1021/acs.jpcb.6c01283

Exploring Biological Quantum Effects in Photosynthesis across Varied Spatial Scale

Author: Ruan, Meixia; Weng, Yuxiang

Journal: JOURNAL OF PHYSICAL CHEMISTRY B. 2026; Vol. 130, Issue 15, pp. 4017-4040. DOI: 10.1021/acs.jpcb.5c07333

Modeling the Phase-Change Memory Material, Ge2Sb2Te with a Machine-Learned Interatomic Potential

引用次数：22

Flex ddG: Rosetta Ensemble-Based Estimation of Changes in Protein-Protein Binding Affinity upon Mutation

引用次数：20

Green Reduced Graphene Oxide Toughened Semi-IPN Monolith Hydrogel as Dual Responsive Drug Release System: Rheological, Physicomechanical, and Electrical Evaluations

引用次数：17

Theoretical Analysis of Carrier Ion Diffusion in Superconcentrated Electrolyte Solutions for Sodium-Ion Batteries

引用次数：16

Is Indolinonic Hydroxylamine a Promising Artificial Antioxidant?

引用次数：15

Membrane Cholesterol Modulates Oligomeric Status and Peptide-Membrane Interaction of Severe Acute Respiratory Syndrome Coronavirus Fusion Peptide

引用次数：15

Inherent Acidity of Perfluorosulfonic Acid Ionomer Dispersions and Implications for Ink Aggregation

引用次数：14

Binding Modes of Ligands Using Enhanced Sampling (BLUES): Rapid Decorrelation of Ligand Binding Modes via Nonequilibrium Candidate Monte Carlo

引用次数：14

Molecular Dynamic Simulations for the Extraction of Quinoline from Heptane in the Presence of a Low-Cost Phosphonium-Based Deep Eutectic Solvent

引用次数：13

Atomistic Scale Analysis of the Carbonization Process for C/H/O/N-Based Polymers with the ReaxFF Reactive Force Field

引用次数：13