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ACS Physical Chemistry Au|October 2, 2023
Theoretical Insights into the Dynamics of Gas-Phase Bimolecular Reactions with Submerged BarriersHongwei Song, Hua GuoACS Physical Chemistry Au|October 2, 2023
Disrupting Dimeric β-Amyloid by Electric FieldsPablo Andrés Vargas-Rosales, Alessio D'Addio, Yang Zhang, et al.ACS Physical Chemistry Au|October 2, 2023
Structure Determination and Refinement of Paramagnetic Materials by Solid-State NMRJonas Koppe, Andrew J PellACS Physical Chemistry Au|October 2, 2023
Delta SARS-CoV-2 s2m Structure, Dynamics, and Entropy: Consequences of the G15U MutationJoseph A Makowski, Adam H Kensinger, Caylee L Cunningham, et al.ACS Physical Chemistry Au|December 23, 2021
Performing Molecular Dynamics Simulations and Computing Hydration Free Energies on the B3LYP-D3(BJ) Potential Energy Surface with Adaptive Force Matching: A Benchmark Study with Seven Alcohols and One AmineDong Zheng, Feng WangACS Physical Chemistry Au|August 8, 2022
Mechanistic Insights into Enzyme Catalysis from Explaining Machine-Learned Quantum Mechanical and Molecular Mechanical Minimum Energy PathwaysZilin Song, Francesco Trozzi, Hao Tian, et al.ACS Physical Chemistry Au|May 30, 2023
Dynamics of Active SiO2-Pt Janus Colloids in Dilute Poly(ethylene oxide) SolutionsHarishwar Raman, Sneham Das, Hrithik Sharma, et al.ACS Physical Chemistry Au|June 1, 2026
Chemical Oxidation of Coronene: A Crystallographic and Computational Study of Charge-Regulated π‑StackingRameswar Bhattacharjee, Megan E McCormack, Yikun Zhu, et al.ACS Physical Chemistry Au|June 1, 2026
Scanning Tunneling Microscope-Based Break-Junction TechniqueA TutorialEmma York, Latha VenkataramanACS Physical Chemistry Au|June 1, 2026
Free-Energy Profiles of Confined Reactions: Influence of Confinement Type and Challenges for Metadynamics MethodsMichelle Ernst, Jürg HutterPageof 35