Molecular electrostatic potentials: an effective tool for the elucidation of biochemical phenomena
about
Virtual and In Vitro Screens Reveal a Potential Pharmacophore that Avoids the Fibrillization of Aβ1-42Binding of polychlorinated biphenyls to the aryl hydrocarbon receptor.Synthesis and structural properties of 2-((10-alkyl-10H-phenothiazin-3-yl)methylene)malononitrile derivatives; a combined experimental and theoretical insightSelective and Scalable Perfluoroarylation of Nitroalkanes.Discovery of σ-hole interactions involving ylides.Photoreactivity, Optical Behavior and DFT Studies of 2,5-Bis[4-choloro-acetyl(thiophen-2-ylmethylene)]cyclopentanone BCTCP in Different Solvents.Hybrid organic-inorganic CH3 NH3 PbI3 perovskite building blocks: Revealing ultra-strong hydrogen bonding and mulliken inner complexes and their implications in materials design.Perspective: Found in translation: Quantum chemical tools for grasping non-covalent interactions.Density functional theory study of structural and electronic properties of trans and cis structures of thiothixene as a nano-drug.Interactions of the "piano-stool" [ruthenium(II)(η(6) -arene)(quinolone)Cl](+) complexes with water; DFT computational study.Electronic structure and conformational properties of 1H-indole-3-acetic acid.Spectroscopic and nonlinear optical properties of new chalcone fluorescent probes for bioimaging applications: a theoretical and experimental study.Exploration of various electronic properties along the reaction coordinate for hydration of Pt(II) and Ru(II) complexes; the CCSD, MPx, and DFT computational study.Adsorption of Emerging Munitions Contaminants on Cellulose Surface: A Combined Theoretical and Experimental Investigation.Electrostatics of DNA nucleotide-carbon nanotube hybrids evaluated from QM:MM simulations.Determination of noncovalent interaction energies from electronic densities.A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles.Introducing DDEC6 atomic population analysis: part 1. Charge partitioning theory and methodologyOptical properties and fluorescence quenching of carbazole containing (D–π–A) push–pull chromophores by silver nanoparticles: a detailed insight via an experimental and theoretical approachQuantum Chemical and Spectroscopic Investigations of (Ethyl 4 hydroxy-3-((E)-(pyren-1-ylimino)methyl)benzoate) by DFT Method
P2860
Q28546473-C3DF547F-19D6-4D7F-8F78-63BA4986F259Q34847222-6B11E261-A503-4735-A18F-CA5666ED90EFQ36686854-3185ADD1-8351-493E-A534-EAE7E8A53080Q41502645-C3207B2C-6767-481D-BBC8-C9D38EF423B6Q44553341-2F33CDBC-812C-4A6B-A4C7-595FFBC27EC3Q46708017-065E1320-CDCF-4FCC-8B6D-6A11A926277DQ47431350-1C88D4DD-CD6F-493B-BBE3-2B4C52FC1EBEQ48042223-D2659582-C92B-4AE3-ADBD-043C57E7D3FAQ49608118-D77B78EA-D9F5-4010-A072-9DB935232B5AQ50210771-C5B97957-72DE-4CF5-9B85-A866DF1605B4Q50442881-36C31C68-6952-436E-9407-810C4B5AD5A6Q50648368-19E01722-D272-4E95-AB99-C6DC9EFF86C3Q51151340-27060969-A79D-4CDF-A14E-E3E0B0113C35Q51369632-5456A3FE-0ADC-4E24-9795-7FAAD9081EF6Q51656315-BC627F52-D634-4EF8-838A-4FB9FB4547FBQ51993447-39000E56-6D5A-47C9-8961-86FE2A3C1A60Q53389531-71B5D665-4C59-42E4-9DC5-565AA6A83400Q56228313-D750DE57-118A-46AD-8008-5587DD1089CEQ56995711-D33C042C-4C36-49B2-A533-FE8C654243F4Q59046908-69C86448-4ACA-4D8C-90FA-F6932E4871B0
P2860
Molecular electrostatic potentials: an effective tool for the elucidation of biochemical phenomena
description
1985 nî lūn-bûn
@nan
1985年の論文
@ja
1985年論文
@yue
1985年論文
@zh-hant
1985年論文
@zh-hk
1985年論文
@zh-mo
1985年論文
@zh-tw
1985年论文
@wuu
1985年论文
@zh
1985年论文
@zh-cn
name
Molecular electrostatic potent ...... ation of biochemical phenomena
@en
Molecular electrostatic potent ...... tion of biochemical phenomena.
@nl
type
label
Molecular electrostatic potent ...... ation of biochemical phenomena
@en
Molecular electrostatic potent ...... tion of biochemical phenomena.
@nl
prefLabel
Molecular electrostatic potent ...... ation of biochemical phenomena
@en
Molecular electrostatic potent ...... tion of biochemical phenomena.
@nl
P2093
P2860
P356
P1476
Molecular electrostatic potent ...... ation of biochemical phenomena
@en
P2093
Jayasuriya K
Laurence PR
Politzer P
P2860
P304
P356
10.1289/EHP.8561191
P577
1985-09-01T00:00:00Z