J. Pranata

发表

Importance of secondary interactions in triply hydrogen bonded complexes: guanine-cytosine vs uracil-2,6-diaminopyridine

William L. Jorgensen, Julianto Pranata, W. L. Jorgensen, 1990 .

Computational studies on fk506 conformational search and molecular dynamics simulation in water

William L. Jorgensen, Julianto Pranata, W. L. Jorgensen, 1991 .

Computational Studies on FK506: Conformational Search and Molecular Dynamics Simulation in Water.

W. L. Jorgensen, J. Pranata, 1992 .

Ab initio conformational analysis of alanine

S. Q. Newton, L. Schäfer, J. Pranata, 1995 .

Band structures of polyfulvene and related polymers. A model for the effects of benzannelation on the band structures of polythiophene, polypyrrole, and polyfulvene

D. A. Dougherty, R. Grubbs, J. Pranata, 1988 .

Ab initio study of the base-catalyzed hydrolysis of methyl formate

J. Pranata, 1994 .

COMPUTATIONAL INVESTIGATIONS OF CARBONYL REACTIONS : COMPARISON BETWEEN NUCLEOPHILIC ADDITION VERSUS ENOLATE FORMATION IN THE REACTION OF ACETALDEHYDE WITH HYDROXIDE ION

J. Pranata, 1996 .

Theoretical studies of the singlet and triplet potential energy surfaces of cyclobutanediyl

J. Pranata, D. Dougherty, 1989 .

Non-Kekule acenes. The dimethylenepolycyclobutadienes, a new class of (4n + 2) alternant hydrocarbons

J. Pranata, D. Dougherty, 1987 .

The ene reaction: Comparison of results of Hartree‐Fock, Møller‐Plesset, CASSCF, and DFT calculations

Julianto Pranata, J. Pranata, 1997 .

Tautomeric Equilibria of 3-Hydroxypyrazole in the Gas Phase and in Solution: A Theoretical Study Combining ab Initio Quantum Mechanics and Monte Carlo Simulation Methods

David M. Miller, B. Teppen, L. Schäfer, 1994 .

Chromium, tungsten, iron, and ruthenium complexes of the 4-membered ring diazene 3,4-diazatricyclo[4.2.1.02,5]non-3-ene

J. Pranata, M. Ackermann, David E. Adams, 1989 .

OPLS potential functions for nucleotide bases. Relative association constants of hydrogen-bonded base pairs in chloroform

William L. Jorgensen, Julianto Pranata, Scott G. Wierschke, 1991 .

Catalytic Hydrogenation of [2.2]Paracyclophane. Unsaturated Intermediates

N. Garti, J. Pranata, P. Skrabal, 1994 .

Vibrational spectra of cyclopropenyl cations (C3H3+, C3D3+, C3H2D+, and C3D2H+) and force constants for this ion system

P. Stevens, J. Sprague, N. Craig, 1986 .

Vibrational spectra and force constants for the perfluorocyclopropenyl cation

G. Fleming, N. Craig, J. Pranata, 1985 .

Vibrational spectra and a potential function for 3-chlorocyclopropene and its various deuterated modifications

P. Stevens, J. Sprague, N. Craig, 1987 .

Monte Carlo simulations yield absolute free energies of binding for guanine—cytosine and adenine—uracil base pairs in chloroform

William L. Jorgensen, Julianto Pranata, W. L. Jorgensen, 1991 .

Force constants for the cyclopropenyl cation

P. Stevens, J. Sprague, N. Craig, 1984 .

Nature of Denaturing Agents: Monte Carlo Simulations of Bimolecular Complexes Involving Urea and N-Methylacetamide in Aqueous Solution

J. Pranata, 1995 .

Empirical evaluation of the influence of side chains on the conformational entropy of the polypeptide backbone

W. Stites, J. Pranata, Wesley E. Stites, 1995, Proteins.

Reaction pathways for proton exchange between protonated formamide and water

J. Pranata, A. Kamitakahara, 1998 .

COMPUTATIONAL INVESTIGATIONS OF REACTIVE INTERMEDIATES IN THE ACID-CATALYZED PROTON EXCHANGE IN FORMAMIDE

Julianto Pranata, J. Pranata, Geraldine D. Davis, 1995 .

Sulfur–Aromatic Interactions: A Computational Study of the Dimethyl Sulfide–Benzene Complex☆

J. Pranata, 1997 .

Theoretical study of 1,3‐dipolar cycloadditions of nitrone and fulminic acid with substituted ethylenes

J. Pranata, Eric C. Magnuson, 1998 .

Reexamination of the conformations of dimethyl phosphate anion in water

J. Pranata, Chih-Li Hsu, A. Kamitakahara, 1995 .

Conformational and tautomeric equilibria of formohydroxamic acid in the gas phase and in aqueous solution

J. Pranata, David Stinchcomb, 1996 .

Monte Carlo Simulations of Guanidinium Acetate and Methylammonium Acetate Ion Pairs in Water

J. Pranata, S. Saigal, 1997 .

Relative basicities of carboxylate lone pairs in aqueous solution

Julianto Pranata, J. Pranata, 1993, J. Comput. Chem..

Importance of secondary interactions in triply hydrogen bonded complexes: guanine-cytosine vs uracil-2,6-diaminopyridine

W. L. Jorgensen, J. Pranata, 1990 .