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- Currently displaying 23721 - 23740 of 29893 publications
Molecule-doped rare gas clusters: structure and stability of ArnNO(X (2)Pi(1/2,3/2)), n <= 25, from new ab initio potential energy surfaces of ArNO
Molecular Physics
(2000)
98
219
(doi: 10.1080/00268970009483285)
Molecule-doped rare gas clusters: structure and stability of ArnNO(X2Π1/2/3/2),n≤ 25, from newab initiopotential energy surfaces of ArNO
Mol. Phys.
(2000)
98
219
(doi: 10.1080/00268970009483285)
Energetics and kinetics of the interaction of acetylene and ethylene with Pd{100} and Ni{100}
Surface Science
(2000)
447
1
The behaviour of liquid alkanes near interfaces
Molecular Physics
(2000)
98
255
(doi: 10.1080/00268970009483289)
The behaviour of liquid alkanes near interfaces
Molecular Physics
(2000)
98
255
(doi: 10.1080/00268970009483289)
Can a pairwise contact potential stabilize native protein folds against decoys obtained by threading?
Proteins: Structure, Function, and Genetics
(2000)
38
134
Ab initio molecular dynamics simulation of liquids and solutions
Journal of Physics Condensed Matter
(2000)
12
A161
(doi: 10.1088/0953-8984/12/8a/318)
Reaction of [Cp2(CO)3Mo2(μ-η2-P2)(PPh2)]- with the cumulenes 3-ClC6H4NCO, PhNCS, and CS2 and with Michael acceptors:: Synthesis and reactivity of [Cp2(CO)3Mo2(μ-η3-Ph2PC(H)SP2S)], a complex containing an unusual CSP2S five-membered ring
Organometallics
(2000)
19
984
(doi: 10.1021/om990729k)
Transition-state structure as a unifying basis in protein-folding mechanisms: Contact order, chain topology, stability, and the extended nucleus mechanism
Proceedings of the National Academy of Sciences of the United States of America
(2000)
97
1525
(doi: 10.1073/pnas.97.4.1525)
Directed evolution of new catalytic activity using the α/β-barrel scaffold (Retracted article. See vol 417, pg 468, 2002)
Nature
(2000)
403
617
(doi: 10.1038/35001001)
Directed evolution of new catalytic activity using the alpha/beta-barrel scaffold.
Nature
(2000)
403
617
(doi: 10.1038/35001001)
Phenomenological damping in optical response tensors
Physical Review A
(2000)
61
035801
(doi: 10.1103/physreva.61.035801)
X-ray diffraction and 13C solid-state NMR studies of the dimethylformamide solvate of tetra(C-undecyl)calix[4]resorcinarene
The Journal of Physical Chemistry B
(2000)
104
1921
(doi: 10.1021/jp991589v)
Perspective on "Statistical mechanical theory of irreversible processes. I. General theory and simple applications to magnetic and conduction problems." - Kubo R (1957) J Phys Soc Jpn 12 : 570
Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)
(2000)
103
234
(doi: 10.1007/s002149900019)
Perspective on “The effect of shape on the interaction of colloidal particles”
Theoretical Chemistry Accounts
(2000)
103
212
(doi: 10.1007/s002149900018)
Mechanistic studies on type I and type II dehydroquinase with (6R)- and (6S)-6-fluoro-3-dehydroquinic acids
Bioorganic & Medicinal Chemistry Letters
(2000)
10
231
Selective oxygen capture to give a unique mixed-anion lithium aluminate:: the synthesis and solid-state structure of {[PhC(O)N(Me)Al(Me)(But)OMe]Li•[PhC(O)N(Me)Al(Me)(OBut)OMe]Li}2
Chemical Communications
(2000)
193
(doi: 10.1039/a909135a)
Pentaprismane and hypostrophene from first-principles, with plane waves
Chemical Physics Letters
(2000)
317
381
Near-infrared laser absorption spectroscopy of the CS+ cation
Chemical Physics Letters
(2000)
317
181
Near-infrared laser absorption spectroscopy of the CS+ cation
Chemical Physics Letters
(2000)
317
181
