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Results: 26-50/69
Authors:
Tang, Y
Ghirlanda, G
Vaidehi, N
Kua, J
Mainz, DT
Goddard, WA
DeGrado, WF
Tirrell, DA
Citation: Y. Tang et al., Stabilization of coiled-coil peptide domains by introduction of trifluoroleucine, BIOCHEM, 40(9), 2001, pp. 2790-2796
Authors:
Aivazis, M
Goddard, WA
Meiron, D
Ortiz, M
Pool, J
Shepherd, J
Citation: M. Aivazis et al., A virtual, test facility for simulating the dynamic response of materials, COMPUT SC E, 2(2), 2000, pp. 42-53
Authors:
Park, C
Goddard, WA
Citation: C. Park et Wa. Goddard, Stabilization of alpha-helices by dipole-dipole interactions within alpha-helices, J PHYS CH B, 104(32), 2000, pp. 7784-7789
Authors:
Goddard, WA
Citation: Wa. Goddard, Critical points and random events that shaped the early career of William A. Goddard III, J PHYS CH A, 104(11), 2000, pp. 2147-2167
Authors:
Yamasaki, T
Mainz, DT
Goddard, WA
Citation: T. Yamasaki et al., Correlation analysis of chemical bonds (CACB) II: Quantum mechanical operators for classical chemical concepts, J PHYS CH A, 104(11), 2000, pp. 2221-2229
Authors:
Chakraborty, D
Muller, RP
Dasgupta, S
Goddard, WA
Citation: D. Chakraborty et al., The mechanism for unimolecular decomposition of RDX (1,3,5-trinitro-1,3,5-triazine), an ab initio study, J PHYS CH A, 104(11), 2000, pp. 2261-2272
Authors:
Vaidehi, N
Goddard, WA
Citation: N. Vaidehi et Wa. Goddard, Domain motions in phosphoglycerate kinase using hierarchical NEIMO molecular dynamics simulations, J PHYS CH A, 104(11), 2000, pp. 2375-2383
Authors:
Knops-Gerrits, PP
Toufar, H
Li, XY
Grobet, P
Schoonheydt, RA
Jacobs, PA
Goddard, WA
Citation: Pp. Knops-gerrits et al., The structure of water in crystalline aluminophosphates: Isolated water and intermolecular clusters probed by Raman spectroscopy, NMR and structural modeling, J PHYS CH A, 104(11), 2000, pp. 2410-2422
Authors:
Park, C
Carlson, MJ
Goddard, WA
Citation: C. Park et al., Solvent effects on the secondary structures of proteins, J PHYS CH A, 104(11), 2000, pp. 2498-2503
Authors:
Zhou, YH
Jiang, SY
Cagin, T
Yamaguchi, ES
Frazier, R
Ho, A
Tang, YC
Goddard, WA
Citation: Yh. Zhou et al., Application of the self-assembled monolayer (SAM) model to dithiophosphateand dithiocarbamate engine wear inhibitors, J PHYS CH A, 104(11), 2000, pp. 2508-2524
Authors:
Knops-Gerrits, PP
Toufar, H
Li, XY
Grobet, P
Schoonheydt, RA
Jacobs, PA
Goddard, WA
Citation: Pp. Knops-gerrits et al., The structure of water in crystalline aluminophosphates: Isolated water and intermolecular clusters probed by Raman spectroscopy, NMR and structural modeling (vol 104, pg 2410, 2000), J PHYS CH A, 104(11), 2000, pp. 2525-2525
Authors:
Che, JW
Cagin, T
Goddard, WA
Citation: Jw. Che et al., Thermal conductivity of carbon nanotubes, NANOTECHNOL, 11(2), 2000, pp. 65-69
Authors:
Cagin, T
Wang, GF
Martin, R
Breen, N
Goddard, WA
Citation: T. Cagin et al., Molecular modelling of dendrimers for nanoscale applications, NANOTECHNOL, 11(2), 2000, pp. 77-84
Authors:
Hua, X
Cagin, T
Che, J
Goddard, WA
Citation: X. Hua et al., QM(DPT) and MD studies on formation mechanisms of C-60 fullerenes, NANOTECHNOL, 11(2), 2000, pp. 85-88
Authors:
La Francois, CJ
Jang, YH
Cagin, T
Goddard, WA
Sowers, LC
Citation: Cj. La Francois et al., Conformation and proton configuration of pyrimidine deoxynucleoside oxidation damage products in water, CHEM RES T, 13(6), 2000, pp. 462-470
Authors:
Floriano, WB
Vaidehi, N
Goddard, WA
Singer, MS
Shepherd, GM
Citation: Wb. Floriano et al., Molecular mechanisms underlying differential odor responses of a mouse olfactory receptor, P NAS US, 97(20), 2000, pp. 10712-10716
Authors:
Che, JW
Cagin, T
Deng, WQ
Goddard, WA
Citation: Jw. Che et al., Thermal conductivity of diamond and related materials from molecular dynamics simulations, J CHEM PHYS, 113(16), 2000, pp. 6888-6900
Authors:
Lee, SW
Cox, H
Goddard, WA
Beauchamp, JL
Citation: Sw. Lee et al., Chemistry in nanodroplets: Studies of protonation sites of substituted anilines in water clusters using FT-ICR, J AM CHEM S, 122(38), 2000, pp. 9201-9205
Authors:
Kua, J
Faglioni, F
Goddard, WA
Citation: J. Kua et al., Thermochemistry for hydrocarbon intermediates chemisorbed on metal surfaces: CHn-m(CH3)(m) with n=1, 2, 3 and m <= n on Pt, Ir, Os, Pd, Ph, and Ru, J AM CHEM S, 122(10), 2000, pp. 2309-2321
Authors:
Claypool, CL
Faglioni, F
Matzger, AJ
Goddard, WA
Lewis, NS
Citation: Cl. Claypool et al., Effects of molecular geometry on the STM image contrast of methyl- and bromo-substituted alkanes and alkanols on graphite, J PHYS CH B, 103(44), 1999, pp. 9690-9699
Authors:
Claypool, CL
Faglioni, F
Goddard, WA
Lewis, NS
Citation: Cl. Claypool et al., Tunneling mechanism implications from an STM study of H3C(CH2)(15)HC=C=CH(CH2)(15)CH3 on graphite and C14H29OH on MoS2, J PHYS CH B, 103(34), 1999, pp. 7077-7080
Authors:
Debe, DA
Carlson, MJ
Sadanobu, J
Chan, SI
Goddard, WA
Citation: Da. Debe et al., Protein fold determination from sparse distance restraints: The RestrainedGeneric Protein Direct Monte Carlo method, J PHYS CH B, 103(15), 1999, pp. 3001-3008
Authors:
Kua, J
Goddard, WA
Citation: J. Kua et Wa. Goddard, Chemisorption of organics on platinum. 2. Chemisorption of C2Hx and CHx onPt(111) (vol 102, pg 9495, 1998), J PHYS CH B, 103(12), 1999, pp. 2318-2318
Authors:
Che, JW
Cagin, T
Goddard, WA
Citation: Jw. Che et al., Generalized extended empirical bond-order dependent force fields includingnonbond interactions, THEOR CH AC, 102(1-6), 1999, pp. 346-354
Authors:
Crellin, KC
Beauchamp, JL
Goddard, WA
Geribaldi, S
Decouzon, M
Citation: Kc. Crellin et al., Sigma-bond metathesis reactions of Sc(OCD3)(2)(+) with water, ethanol, and1-propanol: measurements of equilibrium constants, relative bond strengths, and absolute bond strengths, INT J MASS, 183, 1999, pp. 121-138