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- Currently displaying 24381 - 24400 of 30678 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)
Computers in the Cambridge University organic chemistry courses.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
U181
Novel approach for modeling metals in enzyme active sites:: Force field model for calcium in the active site of phospholipase A2 and application to the design of new inhibitors.
ABSTR PAP AM CHEM S
(2000)
220
U561
Quantum computing from an NMR perspective.
ABSTR PAP AM CHEM S
(2000)
220
U239
Chemistry 2000: The first 2000 days.
ABSTR PAP AM CHEM S
(2000)
220
{39-CINF}
Attila: An efficient method for the conformation searching of cyclic molecules.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
{89-COMP}
Ab initio approach for electro-chemical application.
ABSTR PAP AM CHEM S
(2000)
220
U236
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}
Gas-phase reactions and collisional energy transfer at ultra-low temperatures.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2000)
220
U188
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
J Comb Chem
(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)
Synthesis and structure of [(ButN)P(μ-NBut)2P(PCy)Li2·thf]2; an unusual cage compound containing an amido/phosphido functionalised [(ButN)P(μ-NBut)2P(PCy)]2− dianion (Cy = C6H11)
Chemical Communications
(2000)
1439
(doi: 10.1039/b003468l)
Thermally stable fatigue resistant near infrared active photochromic compounds, exemplified by 6-amino-7-cyano-3-(dicyclopropylmethylene)-4-(2,5-dimethyl-3-furyl)-benzofuran-2(3H)-one
Chemical Communications
(2000)
1397
(doi: 10.1039/b003496g)
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
Solvothermal construction of a coordination polymer around in situ generated pyroglutamic acid: preparation, crystal structure, and magnetic behavior of [Mn(C5H6NO3)2]infinity.
Inorganic Chemistry
(2000)
39
3705
(doi: 10.1021/ic9912427)
Vibrational properties of the one-componentσphase
Physical Review B Condensed Matter and Materials Physics
(2000)
62
3223
(doi: 10.1103/physrevb.62.3223)
