Keith Laidig: search on Z-Library

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1

Origins of relative acidity: First and second period hydrides

Laidig, Keith E., Streitwieser, Andrew

Journal:

Journal of Computational Chemistry

Year:

1996

Language:

english

File:

PDF, 806 KB

english, 1996

2

Conformational search using a molecular dynamics-minimization procedure: Applications to clusters of coulombic charges, Lennard-Jones particles, and waters

Li, Zhenqin, Laidig, Keith E., Daggett, Valerie

Journal:

Journal of Computational Chemistry

Year:

1998

Language:

english

File:

PDF, 214 KB

english, 1998

3

Density functional methods and the spatial distribution of electronic charge

Keith E. Laidig

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 715 KB

english, 1994

4

The atomic origins of the quadrupole and second moments in the series CO2, OCS, and CS2

Keith E. Laidig

Journal:

Chemical Physics

Year:

1992

Language:

english

File:

PDF, 800 KB

english, 1992

5

Complexation of Li+, Na+, and K+ by water and ammonia

Keith E. Laidig, Peter Speers, Andrew Streitwieser

Journal:

Coordination Chemistry Reviews

Year:

2000

Language:

english

File:

PDF, 104 KB

english, 2000

6

[1.1.1]Propellane: Reaction with free radicals

Kenneth B. Wiberg, Shennan T. Waddell, Keith Laidig

Journal:

Tetrahedron Letters

Year:

1986

Language:

english

File:

PDF, 164 KB

english, 1986

7

The atomic basis of the molecular quadrupole moments of benzene and hexafluorobenzene

Keith E. Laidig

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 496 KB

english, 1991

8

The prediction and calculation of properties of atoms in molecules

Richard F.W. Bader, Keith E. Laidig

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1991

Language:

english

File:

PDF, 1.51 MB

english, 1991

9

The use of the charge density to investigate chemical reactions; the displacement of methyl chloride by fluoride ion

Keith E. Laidig

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1992

Language:

english

File:

PDF, 2.78 MB

english, 1992

10

Molecular dynamics simulations of apocytochrome b562– the highly ordered limit of molten globules

Keith E. Laidig, Valerie Daggett

Journal:

Folding and Design

Year:

1996

Language:

english

File:

PDF, 724 KB

english, 1996

11

Properties of atoms in molecules: additivity and transferability of group polarizabilities

Bader, R.F.W., Keith, T.A., Gough, K.M., Laidig, K.E.

Journal:

Molecular Physics

Year:

1992

Language:

english

File:

PDF, 1.44 MB

english, 1992

12

Origin of depressed dipole moments in five-membered, unsaturated heterocycles

Laidig, Keith E., Speers, Peter, Streitwieser, Andrew

Journal:

Canadian Journal of Chemistry

Year:

1996

Language:

english

File:

PDF, 355 KB

english, 1996

13

Properties of atoms in molecules: Atomic polarizabilities

Laidig, Keith E., Bader, Richard F. W.

Journal:

The Journal of Chemical Physics

Year:

1990

Language:

english

File:

PDF, 1.18 MB

english, 1990

14

Calibration and Testing of a Water Model for Simulation of the Molecular Dynamics of Proteins and Nucleic Acids in Solution

Levitt, Michael, Hirshberg, Miriam, Sharon, Ruth, Laidig, Keith E., Daggett, Valerie

Journal:

Journal of Physical Chemistry B

Year:

1997

Language:

english

File:

PDF, 463 KB

english, 1997

15

Electron Delocalization and the Fermi Hole

Bader, Richard F. W., Streitwieser, Andrew, Neuhaus, Arnst, Laidig, Keith E., Speers, Peter

Journal:

Journal of the American Chemical Society

Year:

1996

Language:

english

File:

PDF, 268 KB

english, 1996

16

Barriers to rotation adjacent to double bonds. 3. The carbon-oxygen barrier in formic acid, methyl formate, acetic acid, and methyl acetate. The origin of ester and amide resonance

Wiberg, Kenneth B., Laidig, Keith E.

Journal:

Journal of the American Chemical Society

Year:

1987

Language:

english

File:

PDF, 1.06 MB

english, 1987

17

Acidity of (Z)- and (E)-methyl acetates: relationship to Meldrum's acid

Wiberg, Kenneth B., Laidig, Keith E.

Journal:

Journal of the American Chemical Society

Year:

1988

Language:

english

File:

PDF, 402 KB

english, 1988

18

Origin of the Gauche Effect in substituted ethanes and ethenes

Wiberg, Kenneth B., Murcko, Mark A., Laidig, Keith E., MacDougall, Preston J.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 508 KB

english, 1990

19

Use of nuclear potential to investigate the atomic size dependency of populations defined within the theory of atoms in molecules

Laidig, Keith E.

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 299 KB

english, 1992

20

The ab initio energy difference favoring the nonclassical over the classical structure of the bicyclo[2.1.1]hexyl cation. Comparison of calculated (IGLO) and experimental 13C chemical shifts

Schleyer, Paul v. R., Laidig, Keith., Wiberg, Kenneth B., Saunders, Martin., Schindler, Michael.

Journal:

Journal of the American Chemical Society

Year:

1988

Language:

english

File:

PDF, 276 KB

english, 1988

21

Structures, energies, and modes of interconversion of C4H7+ ions

Saunders, Martin., Laidig, Keith E., Wiberg, Kenneth B., Schleyer, Paul v. R.

Journal:

Journal of the American Chemical Society

Year:

1988

Language:

english

File:

PDF, 963 KB

english, 1988

22

Theoretical calculation of equilibrium isotope effects using ab initio force constants: application to NMR isotope perturbation studies

Saunders, Martin, Laidig, Keith E., Wolfsberg, Max

Journal:

Journal of the American Chemical Society

Year:

1989

Language:

english

File:

PDF, 742 KB

english, 1989

23

Barrier to Rotation in Thioformamide: Implications for Amide Resonance

Laidig, Keith E., Cameron, Lynn M.

Journal:

Journal of the American Chemical Society

Year:

1996

Language:

english

File:

PDF, 188 KB

english, 1996

24

Kinetics of degenerate rearrangements in nortricyclyl cation

Jarret, Ronald M., Veniero, Joseph C., Byrne, Timothy P., Saunders, Martin., Laidig, Keith E.

Journal:

Journal of the American Chemical Society

Year:

1988

Language:

english

File:

PDF, 596 KB

english, 1988

25

Origins of the Acidity Trends in Dimethyl Sulfide, Dimethyl Sulfoxide, and Dimethyl Sulfone

Speers, Peter, Laidig, Keith E., Streitwieser, Andrew

Journal:

Journal of the American Chemical Society

Year:

1994

Language:

english

File:

PDF, 1.06 MB

english, 1994

26

Proton Transfer in Ionic Hydrogen Bonds

Platts, James A., Laidig, Keith E.

Journal:

Journal of Physical Chemistry

Year:

1996

Language:

english

File:

PDF, 446 KB

english, 1996

27

Altering Diffusivity in Biological Solutions through Modification of Solution Structure and Dynamics

Laidig, Keith E., Gainer, John L., Daggett, Valerie

Journal:

Journal of the American Chemical Society

Year:

1998

Language:

english

File:

PDF, 46 KB

english, 1998

28

Substituent effects. 3. A comparison of ethyl, vinyl, isopropyl, and cyclopropyl derivatives

Wiberg, Kenneth B., Laidig, Keith E.

Journal:

Journal of Organic Chemistry

Year:

1992

Language:

english

File:

PDF, 1.03 MB

english, 1992

29

Theoretical studies of protonation and lithiation of first- and second-row aldehydes

Speers, Peter, Laidig, Keith E.

Journal:

Journal of the Chemical Society Perkin Transactions 2

Year:

1994

Language:

english

File:

PDF, 924 KB

english, 1994

30

Searching the Porphyromonas gingivalis genome with peptide fragmentation mass spectra

Chen, Weibin, Laidig, Keith E., Hackett, Murray, Park, Yoonsuk, Park, Kyewhan, Lamont, Richard J., Yates, III, John R.

Journal:

The Analyst (Royal Society of Chemistry)

Year:

2001

Language:

english

File:

PDF, 108 KB

english, 2001

31

Atomic origins of molecular polarizabilities

Laidig, Keith E.

Journal:

Canadian Journal of Chemistry

Year:

1996

Language:

english

File:

PDF, 515 KB

english, 1996

32

What happens to formamide during C—N bond rotation? Atomic and molecular energetics and molecular reactivity as a function of internal rotation

Laidig, Keith E., Cameron, Lynn M.

Journal:

Canadian Journal of Chemistry

Year:

1993

Language:

english

File:

PDF, 566 KB

english, 1993

33

A Theoretical Study of the Proton-Bound Ammonia Dimer

Platts, James A., Laidig, Keith E.

Journal:

Journal of Physical Chemistry

Year:

1995

Language:

english

File:

PDF, 722 KB

english, 1995

34

Reaction of lithium amide with methane: an ab initio and atoms in molecules study

Dixon, Richard E., Streitwieser, Andrew, Laidig, Keith E., Bader, Richard F. W., Harder, Sjoerd

Journal:

Journal of Physical Chemistry

Year:

1993

Language:

english

File:

PDF, 1.04 MB

english, 1993

35

General expression for the spatial partitioning of the moments and multipole moments of molecular charge distributions

Laidig, Keith E.

Journal:

Journal of Physical Chemistry

Year:

1993

Language:

english

File:

PDF, 818 KB

english, 1993

36

Testing the Modified Hydration-Shell Hydrogen-Bond Model of Hydrophobic Effects Using Molecular Dynamics Simulation

Laidig, Keith E., Daggett, Valerie

Journal:

Journal of Physical Chemistry

Year:

1996

Language:

english

File:

PDF, 596 KB

english, 1996

37

Energetics of hydrocarbon branching

Laidig, Keith E.

Journal:

Journal of Physical Chemistry

Year:

1991

Language:

english

File:

PDF, 629 KB

english, 1991