Conformational potential energy surfaces of a Lycopene model

Chasse Gregory Adam, Chasse KP, Kucsman A, Torday László, Papp Gyula
2001

Vitamin E models. Conformational analysis and stereochemistry of tetralin, chroman, thiochroman and selenochroman

Setiadi David H., Chasse Gregory Adam, Torday László, Varró András, Papp Gyula
2002

Vitamin E models. Shortened sidechain models of alpha, beta, gamma and delta tocopherol and tocotrienol - a density functional study

Setiadi David H., Chasse Gregory Adam, Torday László, Varró András, Papp Gyula
2003

Vitamin E models. Can the anti-oxidant and pro-oxidant dichotomy of α-tocopherol be related to ionic ring closing and radical ring opening redox reactions?

Setiadi David H., Chasse Gregory Adam, Torday László, Varró András, Papp Gyula
2003

Molecular computations on lipids a numbering system for phospholipids and triglyceride /

Law Jacqueline M.S, Chasse Gregory Adam, Torday László, Varró András, Papp Gyula
2002

Cationic intermediates in trans- to cis- isomerization reactions of allylic systems. An exploratory ab initio study

Yeung Jenny C.Y, Chasse Gregory Adam, Frondozo Edwin J., Torday László, Papp Gyula
2001

Vitamin E models - The effect of heteroatom substitution in 2-ethyl-2-methyl chroman and 2-ethyl-2-methyl-6-hydroxychroman

Setiadi D.H, Chasse Gregory Adam, Torday László, Varró András, Papp Gyula, Csizmadia Imre Gyula
2002

Conformational dependence of the intrinsic acidity of the aspartic acid residue sidechain in N-acetyl-L-aspartic acid-N '-methylamide

Koo Joseph C.P, Lam Janice S.W, Chasse Gregory Adam, Torday László, Varró András, Papp Gyula
2003

How reliable could economic Hartree-Fock computations be in studying large, folded peptides? A comparative HF and DFT case study on N- and C-protected aspartic acid

Koo JCP, Lam JSW, Salpietro SJ, Chasse Gregory Adam, Enriz RD, Torday László, Varró András, Papp Gyula
2002

Density Functional Molecular Computations on Protonated Serotonin in the Gas Phase and Various Solvent Media

Pisterzi Luca F., Almeida David R.P, Chasse Gregory Adam, Torday László, Papp Gyula, Varró András, Csizmadia Imre Gyula
2002

Density Functional Molecular Study on the Full Conformational Space of the S-4-(2-Hydroxypropoxy)carbazol Fragment of Carvedilol (1-(9H−Carbazol-4-yloxy)-3- [2-(2-methoxyphenoxy)et...

Almeida David R. P., Pisterzi Luca F., Chasse Gregory Adam, Torday László, Varró András, Papp Gyula, Csizmadia Imre Gyula
2002

Exploration of the four-dimensional-conformational potential energy hypersurface of N-acetyl-L-aspartic acid N'-methylamide with its internally hydrogen bonded side-chain orientati...

Koo Joseph C. P., Chasse Gregory Adam, Perczel András, Farkas Ödön, Torday László, Varró András, Papp Gyula, Csizmadia Imre Gyula
2002

N-acetyl-l-aspartic acid-N'-methylamide with side-chain orientation capable of external hydrogen bonding

Koo J. C. P., Chasse Gregory Adam, Perczel András, Farkas Ödön, Varró András, Torday László, Papp Gyula, Csizmadia Imre Gyula
2002

An ab initio computational study on selected lycopene isomers

Chasse Gregory Adam, Mak Melody L., Deretey Eugen, Farkas Imre, Torday László, Papp Gyula, Sarma Dittakavi S.R, Agarwal Anita, Chakravarthi Sujatha, Agarwal Sanjiv, Rao A. Venket
2001

Prospects in computational molecular medicine a millennial mega-project on peptide folding /

Berg M.A, Chasse Gregory Adam, Deretey E., Fuzery A.K, Fung B.M, Fung D.Y.K, Henry-Riyad H., Lin A.C, Mak M.L, Mantas A., Perczel András, Csonka Gábor István, Farkas Ödön, Torday László, Csizmadia Imre Gyula, et al
2000