Quantum Chemistry
8,532 papers
Quantum Chemistry Research Context
This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.
Showing 8161-8172 of 8,532
Quantitative relationships between molecular structures, environmental temperatures and solid vapor pressures of PCDD/Fs.
Ding G, Chen J, Qiao X, Huang L, Lin J, Chen X
2006
PubMed
Chemosphere
Quantitative structure-activity relationship models for prediction of sensory irritants (logRD50) of volatile organic chemicals.
Luan F, Ma W, Zhang X, Zhang H, Liu M, Hu Z, Fan BT
2006
PubMed
Chemosphere
Quantitative structure-property relationships on photodegradation of polybrominated diphenyl ethers.
Niu J, Shen Z, Yang Z, Long X, Yu G
2006
PubMed
Chemosphere
Quantum chemical analysis of alternative pathways for iron activation step for artemisinin, a new antimalarial drug.
Wiwanitkit V
2006
PubMed
The Journal of infection
Quantum chemical simulation of excited states of chlorophylls, bacteriochlorophylls and their complexes.
Linnanto J, Korppi-Tommola J
2006
PubMed
Physical chemistry chemical physics : PCCP
Quantum chemical, ballistic and explosivity calculations on 2,4,6,8-tetranitro-1,3,5,7-tetraaza cyclooctatetraene: a new high energy molecule.
Gejji SP, Talawar MB, Mukundan T, Kurian EM
2006
PubMed
Journal of hazardous materials
Quantum mechanical description of the interactions between DNA and water.
Westerhoff LM, Merz KM Jr
2006
PubMed
Journal of molecular graphics & modelling
Response of wheat seedlings to ni stress: effects of supplemental calcium.
Ouzounidou G, Moustakas M, Symeonidis L, Karataglis S
2006
PubMed
Archives of environmental contamination and toxicology
Separation of 47Ti and 49Ti solid-state NMR lineshapes by static QCPMG experiments at multiple fields.
Larsen FH, Farnan I, Lipton AS
2006
PubMed
Journal of magnetic resonance (San Diego, Calif. : 1997)
Simultaneous detection of Escherichia coli O157:H7 and Salmonella Typhimurium using quantum dots as fluorescence labels.
Yang L, Li Y
2006
PubMed
The Analyst
Six-dimensional potential energy surface for H2 at Ru(0001).
Luppi M, Olsen RA, Baerends EJ
2006
PubMed
Physical chemistry chemical physics : PCCP
Solid-state NMR structural studies of the fibril form of a mutant mouse prion peptide PrP89-143(P101L).
Lim KH, Nguyen TN, Damo SM, Mazur T, Ball HL, Prusiner SB, Pines A, Wemmer DE
2006
PubMed
Solid state nuclear magnetic resonance