𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Fast Photoisomerization of a Rhodopsin Model—An Ab Initio Molecular Dynamics Study

✍ Scribed by Volker Buß; Oliver Weingart; Minoru Sugihara


Publisher
John Wiley and Sons
Year
2000
Tongue
English
Weight
119 KB
Volume
39
Category
Article
ISSN
0044-8249

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Interconversion pathways of the protonat
✍ Frank Terstegen; Emily A. Carter; Volker Buss 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 182 KB 👁 1 views

Ab initio molecular dynamics at the RHFr3-21G level have been ## Ž . performed to study interconversion pathways bond rotation and ring inversion of the protonated ␤-ionone Schiff base. Starting with different stationary points on the Born᎐Oppenheimer potential energy surface, the trajectories ar

A Preliminary Study of Host-Guest Intera
✍ Giuseppe Milano; Gaetano Guerra; Luigi Cavallo 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 125 KB 👁 2 views

A systematic ab initio investigation of the complexes rationalized in terms of the electrostatic fields generated by the interacting molcules. Higher binding energies have been benzene/halogen molecules is presented. For the whole halogen series, the T-shaped geometry is clearly favored calculated o