✦ LIBER ✦

AN EXTENDED SEMI-EMPIRICAL MOLECULAR ORBITAL STUDY OF THE * EXCITED STATES OF NUCLEIC ACID BASES

✍ Scribed by Patrik R. Callis

Book ID: 114894817
Publisher: John Wiley and Sons
Year: 1986
Tongue: English
Weight: 811 KB
Volume: 44
Category: Article
ISSN: 0031-8655
DOI: 10.1111/j.1751-1097.1986.tb04670.x

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Molecular-orbital study of the relative

Molecular-orbital study of the relative stability of protonated nucleic acid base pairs

✍ A.A. Voityuk; A.A. Bliznyuk 📂 Article 📅 1990 🏛 Elsevier Science 🌐 English ⚖ 641 KB

A molecular orbital study on the alkylat

A molecular orbital study on the alkylation and depurination reactions of the base components of nucleic acids

✍ Akira Imamura; Hiroko Fujita; Chikayoshi Nagata 📂 Article 📅 1972 🏛 Elsevier Science 🌐 English ⚖ 606 KB

The transition state for the epoxidation

The transition state for the epoxidation of ethylene with peroxyformic acid. An ab initio molecular orbital study

✍ Plesnicar, Bozo; Tasevski, Milan; Azman, Andrej 📂 Article 📅 1978 🏛 American Chemical Society 🌐 English ⚖ 414 KB

The electronically excited and ionic sta

The electronically excited and ionic states of sulphur dioxide: an ab initio molecular orbital CI study and comparison with spectral data

✍ Palmer *, Michael H.; Shaw, David A.; Guest, Martyn F. 📂 Article 📅 2005 🏛 Taylor and Francis Group 🌐 English ⚖ 484 KB

A study of the molecular orbital localiz

A study of the molecular orbital localization into an extended Hartree—Fock approach: Application to the BeH2 ground state

✍ Yves G. Smeyers; A. González-Guerra; J. Martín-González; P. Fernández-Serra 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 831 KB

In this article, we present a study of the localization and properties of the molecular orbitals (MOs) of polyatomic systems by using a comprehensive version of the G1 model. In this version, the wave function is written as a DODS product of univocally determined spin orbitals (MOs), "projected" on

The interaction of carbohydrates and ami

The interaction of carbohydrates and amino acids with aromatic systems studied by density functional and semi-empirical molecular orbital calculations with dispersion corrections

✍ Sharma, Raman; McNamara, Jonathan P.; Raju, Rajesh K.; Vincent, Mark A.; Hillier 📂 Article 📅 2008 🏛 Royal Society of Chemistry 🌐 English ⚖ 820 KB