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- Currently displaying 24821 - 24840 of 31110 publications
Nuclear shielding constants by density functional theory with gauge including atomic orbitals
The Journal of Chemical Physics
(2000)
113
2983
(doi: 10.1063/1.1287056)
The structure and spectroscopy of monolayers of water on MgO: An ab initio study
The Journal of Chemical Physics
(2000)
113
3344
(doi: 10.1063/1.1287276)
Extended corresponding-states behavior for particles with variable range attractions
Journal of Chemical Physics
(2000)
113
2941
(doi: 10.1063/1.1288684)
Quantum computing from an NMR perspective.
ABSTR PAP AM CHEM S
(2000)
220
U239
Novel approach for modeling metals in enzyme active sites: Force field model for calcium in the active site of phospholipase A(2) and application to the design of new inhibitors.
ABSTR PAP AM CHEM S
(2000)
220
U561
Gas-phase reactions and collisional energy transfer at ultra-low temperatures.
ABSTR PAP AM CHEM S
(2000)
220
U188
Ab initio approach for electro-chemical application.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
U236
Computers in the Cambridge University organic chemistry courses.
ABSTR PAP AM CHEM S
(2000)
220
U181
Computational analysis of the competitive formation of acetals: An application to the synthesis of zaragozic acid.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
{382-ORGN}
Attila: An efficient method for the conformation searching of cyclic molecules.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
U290
Chemistry 2000: The first 2000 days.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
U200
Therapeutic heterocyclic compounds
(2000)
Computation of the pK of liquid water using coordination constraints
Chemical Physics
(2000)
258
139
Biophysical characterization of elongin C from Saccharomyces cerevisiae
Biochemistry
(2000)
39
11137
(doi: 10.1021/bi0008231)
Combined application of analytical techniques for the characterization of polymer supported species.
Journal of Combinatorial Chemistry
(2000)
2
491
(doi: 10.1021/cc000021p)
Vibrational Relaxation of Highly Excited Toluene in Collisions with He, Ar, and N2at Temperatures down to 38 K
The Journal of Physical Chemistry A
(2000)
104
10347
(doi: 10.1021/jp0014216)
Thermally stable fatigue resistant near infrared active photochromic compounds, exemplified by 6-amino-7-cyano-3-(dicyclopropylmethylene)-4-(2,5-dimethyl-3-furyl)-benzofura n-2(3H)-one
Chemical Communications
(2000)
1397
(doi: 10.1039/b003496g)
Synthesis and structure of [((BuN)-N-t)P(mu-NBut)(2)P(PCy)Li-2 center dot thf](2); an unusual cage compound containing an amido/phosphido functionalised [((BuN)-N-t)P(mu-NBut)(2)P(PCy)](2-) dianion (Cy = C6H11)
Chemical Communications
(2000)
1439
(doi: 10.1039/b003468l)
Strategies for the synthesis of fluorescently labelled PNA.
Tetrahedron Letters
(2000)
41
6153
Chemo-enzymatic synthesis of fluorinated sugar nucleotide: Useful mechanistic probes for glycosyltransferases
Bioorganic & medicinal chemistry
(2000)
8
1937
