𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Automatic assignment of bond orders based on the analysis of the internal coordinates of molecular structures

✍ Scribed by Elke Lang; Claus-Wilhelm von der Lieth; Thomas Förster


Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
486 KB
Volume
265
Category
Article
ISSN
0003-2670

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


On the vibration analysis of adhesively
✍ R. Winkler; M. Merkel; A. Öchsner; W. Günter 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 160 KB

## Abstract Metal hollow sphere structures represent a new material group. Within the design progress classical materials are replaced by these new class when a series of physical / mechanical requirements are touched. Typical requirements are related to strength, stiffness, electrical or thermal c

On the convergence of the conformational
✍ Andrea Amadei; Marc A. Ceruso; Alfredo Di Nola 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 119 KB 👁 2 views

In this article we present a quantitative evaluation of the convergence of the conformational coordinates of proteins, obtained by the Essential Dynamics method. Using a detailed analysis of long molecular dynamics trajectories in combination with a statistical assessment of the significance of the