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Results: 1-18 |
Results: 18
CONFORMATIONAL SEARCH USING A MOLECULAR DYNAMICS-MINIMIZATION PROCEDURE - APPLICATIONS TO CLUSTERS OF COULOMBIC CHARGES, LENNARD-JONES PARTICLES, AND WATERS
Authors: LI ZQ LAIDIG KE DAGGETT V
Citation: Zq. Li et al., CONFORMATIONAL SEARCH USING A MOLECULAR DYNAMICS-MINIMIZATION PROCEDURE - APPLICATIONS TO CLUSTERS OF COULOMBIC CHARGES, LENNARD-JONES PARTICLES, AND WATERS, Journal of computational chemistry, 19(1), 1998, pp. 60-70
ALTERING DIFFUSIVITY IN BIOLOGICAL SOLUTIONS THROUGH MODIFICATION OF SOLUTION STRUCTURE AND DYNAMICS
Authors: LAIDIG KE GAINER JL DAGGETT V
Citation: Ke. Laidig et al., ALTERING DIFFUSIVITY IN BIOLOGICAL SOLUTIONS THROUGH MODIFICATION OF SOLUTION STRUCTURE AND DYNAMICS, Journal of the American Chemical Society, 120(36), 1998, pp. 9394-9395
CALIBRATION AND TESTING OF A WATER MODEL FOR SIMULATION OF THE MOLECULAR-DYNAMICS OF PROTEINS AND NUCLEIC-ACIDS IN SOLUTION
Authors: LEVITT M HIRSHBERG M SHARON R LAIDIG KE DAGGETT V
Citation: M. Levitt et al., CALIBRATION AND TESTING OF A WATER MODEL FOR SIMULATION OF THE MOLECULAR-DYNAMICS OF PROTEINS AND NUCLEIC-ACIDS IN SOLUTION, JOURNAL OF PHYSICAL CHEMISTRY B, 101(25), 1997, pp. 5051-5061
MOLECULAR-DYNAMICS SIMULATIONS OF APOCYTOCHROME B(562) - THE HIGHLY ORDERED LIMIT OF MOLTEN GLOBULES
Authors: LAIDIG KE DAGGETT V
Citation: Ke. Laidig et V. Daggett, MOLECULAR-DYNAMICS SIMULATIONS OF APOCYTOCHROME B(562) - THE HIGHLY ORDERED LIMIT OF MOLTEN GLOBULES, Folding & design, 1(5), 1996, pp. 335-346
ORIGINS OF RELATIVE ACIDITY - FIRST AND 2ND PERIOD HYDRIDES
Authors: LAIDIG KE STREITWIESER A
Citation: Ke. Laidig et A. Streitwieser, ORIGINS OF RELATIVE ACIDITY - FIRST AND 2ND PERIOD HYDRIDES, Journal of computational chemistry, 17(15), 1996, pp. 1771-1781
PROTON-TRANSFER IN IONIC HYDROGEN-BONDS
Authors: PLATTS JA LAIDIG KE
Citation: Ja. Platts et Ke. Laidig, PROTON-TRANSFER IN IONIC HYDROGEN-BONDS, Journal of physical chemistry, 100(32), 1996, pp. 13455-13461
TESTING THE MODIFIED HYDRATION-SHELL HYDROGEN-BOND MODEL OF HYDROPHOBIC EFFECTS USING MOLECULAR-DYNAMICS SIMULATION
Authors: LAIDIG KE DAGGETT V
Citation: Ke. Laidig et V. Daggett, TESTING THE MODIFIED HYDRATION-SHELL HYDROGEN-BOND MODEL OF HYDROPHOBIC EFFECTS USING MOLECULAR-DYNAMICS SIMULATION, Journal of physical chemistry, 100(14), 1996, pp. 5616-5619
ATOMIC ORIGINS OF MOLECULAR POLARIZABILITIES
Authors: LAIDIG KE
Citation: Ke. Laidig, ATOMIC ORIGINS OF MOLECULAR POLARIZABILITIES, Canadian journal of chemistry, 74(6), 1996, pp. 1131-1138
ORIGIN OF DEPRESSED DIPOLE-MOMENTS IN 5-MEMBERED, UNSATURATED HETEROCYCLES
Authors: LAIDIG KE SPEERS P STREITWIESER A
Citation: Ke. Laidig et al., ORIGIN OF DEPRESSED DIPOLE-MOMENTS IN 5-MEMBERED, UNSATURATED HETEROCYCLES, Canadian journal of chemistry, 74(6), 1996, pp. 1215-1220
BARRIER TO ROTATION IN THIOFORMAMIDE - IMPLICATIONS FOR AMIDE RESONANCE
Authors: LAIDIG KE CAMERON LM
Citation: Ke. Laidig et Lm. Cameron, BARRIER TO ROTATION IN THIOFORMAMIDE - IMPLICATIONS FOR AMIDE RESONANCE, Journal of the American Chemical Society, 118(7), 1996, pp. 1737-1742
ELECTRON DELOCALIZATION AND THE FERMI HOLE
Authors: BADER RFW STREITWIESER A NEUHAUS A LAIDIG KE SPEERS P
Citation: Rfw. Bader et al., ELECTRON DELOCALIZATION AND THE FERMI HOLE, Journal of the American Chemical Society, 118(21), 1996, pp. 4959-4965
A THEORETICAL-STUDY OF THE PROTON-BOUND AMMONIA DIMER
Authors: PLATTS JA LAIDIG KE
Citation: Ja. Platts et Ke. Laidig, A THEORETICAL-STUDY OF THE PROTON-BOUND AMMONIA DIMER, Journal of physical chemistry, 99(17), 1995, pp. 6487-6492
THEORETICAL-STUDIES OF PROTONATION AND LITHIATION OF FIRST-ROW AND 2ND-ROW ALDEHYDES
Authors: SPEERS P LAIDIG KE
Citation: P. Speers et Ke. Laidig, THEORETICAL-STUDIES OF PROTONATION AND LITHIATION OF FIRST-ROW AND 2ND-ROW ALDEHYDES, Perkin transactions. 2, (4), 1994, pp. 799-806
DENSITY-FUNCTIONAL METHODS AND THE SPATAL DISTRIBUTION OF ELECTRONIC CHARGE
Authors: LAIDIG KE
Citation: Ke. Laidig, DENSITY-FUNCTIONAL METHODS AND THE SPATAL DISTRIBUTION OF ELECTRONIC CHARGE, Chemical physics letters, 225(1-3), 1994, pp. 285-292
ORIGINS OF THE ACIDITY TRENDS IN DIMETHYL SULFIDE, DIMETHYL-SULFOXIDE, AND DIMETHYL SULFONE
Authors: SPEERS P LAIDIG KE STREITWIESER A
Citation: P. Speers et al., ORIGINS OF THE ACIDITY TRENDS IN DIMETHYL SULFIDE, DIMETHYL-SULFOXIDE, AND DIMETHYL SULFONE, Journal of the American Chemical Society, 116(20), 1994, pp. 9257-9261
GENERAL EXPRESSION FOR THE SPATIAL PARTITIONING OF THE MOMENTS AND MULTIPOLE MOMENTS OF MOLECULAR CHARGE-DISTRIBUTIONS
Authors: LAIDIG KE
Citation: Ke. Laidig, GENERAL EXPRESSION FOR THE SPATIAL PARTITIONING OF THE MOMENTS AND MULTIPOLE MOMENTS OF MOLECULAR CHARGE-DISTRIBUTIONS, Journal of physical chemistry, 97(49), 1993, pp. 12760-12767
REACTION OF LITHIUM AMIDE WITH METHANE - AN ABINITIO AND ATOMS IN MOLECULES STUDY
Authors: DIXON RE STREITWIESER A LAIDIG KE BADER RFW HARDER S
Citation: Re. Dixon et al., REACTION OF LITHIUM AMIDE WITH METHANE - AN ABINITIO AND ATOMS IN MOLECULES STUDY, Journal of physical chemistry, 97(15), 1993, pp. 3728-3736
WHAT HAPPENS TO FORMAMIDE DURING C-N BOND ROTATION - ATOMIC AND MOLECULAR ENERGETICS AND MOLECULAR REACTIVITY AS A FUNCTION OF INTERNAL-ROTATION
Authors: LAIDIG KE CAMERON LM
Citation: Ke. Laidig et Lm. Cameron, WHAT HAPPENS TO FORMAMIDE DURING C-N BOND ROTATION - ATOMIC AND MOLECULAR ENERGETICS AND MOLECULAR REACTIVITY AS A FUNCTION OF INTERNAL-ROTATION, Canadian journal of chemistry, 71(6), 1993, pp. 872-879
Risultati: 1-18 |