Authors:
MCALLISTER MA
ENDREDI G
VIVIANI W
PERCZEL A
CSASZAR P
LADIK J
RIVAIL JL
CSIZMADIA IG
Citation: Ma. Mcallister et al., PEPTIDE MODELS .11. SUBSTITUTION EFFECTS ON PEPTIDE CHAINS - THE MAGNITUDE OF SIDE-CHAIN-BACKBONE INTERACTIONS IN OLIGOPEPTIDES HCO-(NHCHRCO)(N)-NH(2)FOR R=CH3 - AN AB-INITIO STUDY, Canadian journal of chemistry, 73(10), 1995, pp. 1563-1572
Authors:
ALLEN AD
COLOMVAKOS JD
EGLE I
LUSZTYK J
MCALLISTER MA
TIDWELL TT
WAGNER BD
ZHAO DC
Citation: Ad. Allen et al., KINETIC AND THEORETICAL-STUDIES OF RING-CLOSURE OF UNSTABILIZED BISKETENES TO CYCLOBUTENEDIONES, Journal of the American Chemical Society, 117(28), 1995, pp. 7552-7553
Authors:
WERSTIUK NH
MA JG
MCALLISTER MA
TIDWELL TT
ZHAO DC
Citation: Nh. Werstiuk et al., CONFORMATION PROPERTIES OF BUTA-1,3-DIENE-1,4-DIONES (BISKETENES) - COMPUTATIONAL AND PHOTOELECTRON SPECTROSCOPIC STUDIES, Journal of the Chemical Society. Faraday transactions, 90(22), 1994, pp. 3383-3390
Citation: Ma. Mcallister et Tt. Tidwell, SUBSTITUENT EFFECTS ON THE STRUCTURES AND ENERGIES OF ISOCYANATES ANDIMINES BY AB-INITIO MOLECULAR-ORBITAL CALCULATIONS, Perkin transactions. 2, (10), 1994, pp. 2239-2248
Authors:
CHEUNG M
MCGOVERN ME
JIN T
ZHAO DC
MCALLISTER MA
FARKAS O
PERCZEL A
CSASZAR P
CSIZMADIA IG
Citation: M. Cheung et al., PEPTIDE MODELS .10. TOPOLOGICAL FEATURES OF MOLECULAR MECHANICS AND AB-INITIO 6D-RAMACHANDRAN MAPS - CONFORMATIONAL DATA FOR AC-L-ALA-L-ALA-L-ALA-NHME AND FOR-L-ALA-L-ALA-L-ALA-NH2, Journal of molecular structure. Theochem, 115(2), 1994, pp. 151-224
Authors:
ENDREDI G
LIEGENER CM
MCALLISTER MA
PERCZEL A
LADIK J
CSIZMADIA IG
Citation: G. Endredi et al., PEPTIDE MODELS .8. THE USE OF A MODIFIED ROMBERG FORMALISM FOR THE EXTRAPOLATION OF MOLECULAR-PROPERTIES FROM OLIGOMERS TO POLYMERS - POLYALANINE DIAMIDE IN ITS EXTENDED LIKE OR (BETA(L))(N) OR (C5)(N) CONFORMATION, Journal of molecular structure. Theochem, 112(1), 1994, pp. 1-7
Citation: Ma. Mcallister et Tt. Tidwell, STRUCTURAL AND SUBSTITUENT EFFECTS ON THE KETENE INFRARED STRETCHING FREQUENCY, Canadian journal of chemistry, 72(3), 1994, pp. 882-887
Authors:
PERCZEL A
MCALLISTER MA
CSASZAR P
CSIZMADIA IG
Citation: A. Perczel et al., PEPTIDE MODELS .9. A COMPLETE CONFORMATIONAL SET OF FOR-ALA-ALA-NH2 FROM AB INITO COMPUTATIONS, Canadian journal of chemistry, 72(10), 1994, pp. 2050-2070
Authors:
HOUK KN
LI Y
MCALLISTER MA
ODOHERTY G
PAQUETTE LA
SIEBRAND W
SMEDARCHINA ZK
Citation: Kn. Houk et al., MECHANISTIC ANALYSIS OF DOUBLE HYDROGEN DYOTROPY IN SYN-SESQUINORBORNENE DISULFONES - A COMBINED KINETIC AND THEORETICAL EVALUATION OF PRIMARY DEUTERIUM-ISOTOPE EFFECTS, Journal of the American Chemical Society, 116(24), 1994, pp. 10895-10913
Citation: Ma. Mcallister et Tt. Tidwell, AB-INITIO CALCULATIONS OF THE RING-OPENING OF CYCLOBUTENE-1,2-DIONES AND CONFORMATIONAL PROPERTIES OF THE PRODUCT 1,3-BUTADIENE-1,4-DIONES (BISKETENES), Journal of the American Chemical Society, 116(16), 1994, pp. 7233-7238
Authors:
MCALLISTER MA
PERCZEL A
CSASZAR P
VIVIANI W
RIVAIL JL
CSIZMADIA IG
Citation: Ma. Mcallister et al., PEPTIDE MODELS .4. TOPOLOGICAL FEATURES OF MOLECULAR MECHANICS AND AB-INITIO 2D-RAMACHANDRAN MAPS - CONFORMATIONAL DATA FOR FOR-GLY-NH2, FOR-L-ALA-NH2, AC-L-ALA-NHME AND FOR-L-VAL-NH2, Journal of molecular structure. Theochem, 107(3), 1993, pp. 161-179
Authors:
MCALLISTER MA
PERCZEL A
CSASZAR P
CSIZMADIA IG
Citation: Ma. Mcallister et al., PEPTIDE MODELS .5. TOPOLOGICAL FEATURES OF MOLECULAR MECHANICS AND AB-INITIO 4D-RAMACHANDRAN MAPS - CONFORMATIONAL DATA FOR AC-L-ALA-L-ALA-NHME AND FOR-L-ALA-L-ALA-NH2, Journal of molecular structure. Theochem, 107(3), 1993, pp. 181-198
Authors:
LIEGENER CM
ENDREDI G
MCALLISTER MA
PERCZEL A
LADIK J
CSIZMADIA IG
Citation: Cm. Liegener et al., USE OF A MODIFIED ROMBERG FORMALISM FOR THE EXTRAPOLATION OF MOLECULAR-PROPERTIES FROM OLIGOMERS TO POLYMERS - POLYALANINE DIAMIDE IN ITS (GAMMA-L)N OR (C7)N CONFORMATION, Journal of the American Chemical Society, 115(18), 1993, pp. 8275-8277
Authors:
PERCZEL A
MCALLISTER MA
CSASZAR P
CSIZMADIA IG
Citation: A. Perczel et al., PEPTIDE MODELS .6. NEW BETA-TURN CONFORMATIONS FROM ABINITIO CALCULATIONS CONFIRMED BY X-RAY DATA OF PROTEINS, Journal of the American Chemical Society, 115(11), 1993, pp. 4849-4858