2015.3.26-29The 95th CSJ Annual Meeting[Funabashi Campus, College of Science and Technology, Nihon University (Chiba, Japan)]
2S4-08 Establishing Computational Molecular Technology towards Macroscopic Chemical Phenomena-Molecular Control of Complex Chemical Reactions, Stereospecificity and Aggregate Structures
1F3-16 Theoretical Study on Anisotropic Diffusion Behavior of Oligomers in One-Dimensional Channels of Porous Coordination Polymers
1B1-37 Reactant Complex Structure in Initiation Reaction of Ring-Opening Polymerization of Lactone Catalyzed by Cyclodextrin: Molecular Dynamics Approach
3B6-39 Microscopic additive effect of fluoroethylene carbonate on the solid-electrolyte interphase (SEI) film formation in sodium-ion battery
Lecture XIII-3 Toward Controlling Complex Chemical Reactions in the "Molecular Aggregation States" -From Multiscale Simulation to Computational Molecular Technology-
PA-15 Dual Approach to Vibrational Spectra in Solution: Microscopic Influence of Hydrogen Bonding to the State of Motion of Glycine in Water
PB-26 On Electrolyte-Dependent Formation of Solid Electrolyte Interphase (SEI) Film in Lithium-Ion Batteries
IC143 Toward controlling complex chemical reactions in the 'molecular aggregation states' -from multiscale simulation to computational molecular technology
PP494 Dual approach to vibrational spectra in solution: microscopic influence of hydrogen bonding to the state of motion of glycine in water
PP520 Multiple oxygen entry pathways in T-state human hemoglobin revealed by intrinsic pathway identification method
2P085 Non-site-specific allosteric effect of oxygen on human hemoglobin under high oxygen partial pressure
2P098 Coordination structure and reactivity of lactone in the vicinity of cyclodextrin dimer
2P09 Development of Dual Approach to Vibrational Spectra in Solution
2P14 Theoretical study on oxygen entry pathways in T-state human hemoglobin
2P15 Theoretical analysis on formation of solid electrolyte interphase (SEI) film in lithium-ion batteries
2P16 Polymerization reaction process and nanostructure analysis of aromatic polyamide membrane: Application of hybrid MC/MD reaction method