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Dobado, J.A., Molina, J.Molina, Espinosa, M.Rodríguez (1994) A comparative molecular mechanics, semiempirical and ab initio study of saturated five-membered rings. Journal of Molecular Structure: THEOCHEM, 303. 205-212 doi:10.1016/0166-1280(94)80186-x

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Reference TypeJournal (article/letter/editorial)
TitleA comparative molecular mechanics, semiempirical and ab initio study of saturated five-membered rings
JournalJournal of Molecular Structure: THEOCHEM
AuthorsDobado, J.A.Author
Molina, J.MolinaAuthor
Espinosa, M.RodríguezAuthor
Year1994 (January)Volume303
PublisherElsevier BV
DOIdoi:10.1016/0166-1280(94)80186-xSearch in ResearchGate
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Mindat Ref. ID8782878Long-form Identifiermindat:1:5:8782878:4
GUID0
Full ReferenceDobado, J.A., Molina, J.Molina, Espinosa, M.Rodríguez (1994) A comparative molecular mechanics, semiempirical and ab initio study of saturated five-membered rings. Journal of Molecular Structure: THEOCHEM, 303. 205-212 doi:10.1016/0166-1280(94)80186-x
Plain TextDobado, J.A., Molina, J.Molina, Espinosa, M.Rodríguez (1994) A comparative molecular mechanics, semiempirical and ab initio study of saturated five-membered rings. Journal of Molecular Structure: THEOCHEM, 303. 205-212 doi:10.1016/0166-1280(94)80186-x
In(n.d.) Journal of Molecular Structure: THEOCHEM Vol. 303. Elsevier BV

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Molina, J.Molina, Espinosa, M.Rodríguez (1994) Structural study of β-D-arabinofuranosyluracil derivatives with known antiviral activity. Journal of Molecular Structure: THEOCHEM, 305. 35-53 doi:10.1016/0166-1280(94)80140-1
Molina, J.Molina, Espinosa, M.Rodríguez (1995) Theoretical studies of 5-X-2′-deoxyuracils with known antiviral activity. Part 2. A comparison of molecular mechanics, AM1, and PM3 methodologies. Journal of Molecular Structure: THEOCHEM, 333. 111-119 doi:10.1016/0166-1280(94)03945-h
Molina Molina, J., Espinosa, M.Rodríguez (1995) Theoretical studies of 5-X-2′-deoxyuracils with known antiviral activity. A comparison of molecular mechanics, AM1, and PM3 semiempirical molecular orbital calculations. Journal of Molecular Structure: THEOCHEM, 332. 75-83 doi:10.1016/0166-1280(94)03901-v
Dobado, J.A, Molina Molina, José, Portal Olea, Dolores (1998) Ab initio molecular study of hydrogen peroxide. Journal of Molecular Structure: THEOCHEM, 433. 181-192 doi:10.1016/s0166-1280(98)00024-4
Iglesias, E., Sordo, T.L., Sordo, J.A. (1994) Molecular associations from ab initio pair potentials. Journal of Molecular Structure: THEOCHEM, 309. 81-91 doi:10.1016/0166-1280(94)80065-0
Iglesias, E., Sordo, T.L., Sordo, J.A. (1994) Molecular associations from ab initio pair potentials. Journal of Molecular Structure: THEOCHEM, 309. 93-103 doi:10.1016/0166-1280(94)80066-9
Mastryukov, Vladimir S., Boggs, James E. (1995) Structure and conformation of some saturated four-membered rings,. Journal of Molecular Structure: THEOCHEM, 338. 235-248 doi:10.1016/0166-1280(94)04063-x
Hotokka, Matti, Lönnberg, Harri (1996) Hydrolysis of adenosine. A semiempirical and ab initio study. Journal of Molecular Structure: THEOCHEM, 363. 191-201 doi:10.1016/0166-1280(95)04440-x
Balázs, András (1987) A comparative ab initio study of amides. Journal of Molecular Structure: THEOCHEM, 153. 103-120 doi:10.1016/0166-1280(87)85008-x
Chakrabborty, D., Yash, A., Manogaran, S. (1994) Ground state vibrations of N-glycylglycine hydrochloride: an ab initio study. Journal of Molecular Structure: THEOCHEM, 303. 265-273 doi:10.1016/0166-1280(94)80192-4
Tarakeshwar, P., Manogaran, S. (1994) Conformational effects on vibrational frequencies of cysteine and serine: an ab initio study. Journal of Molecular Structure: THEOCHEM, 305. 205-224 doi:10.1016/0166-1280(94)80157-6
 
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