✦ LIBER ✦

Conformational variety for the ansa chain of rifamycins: Comparison of observed crystal structures and molecular dynamics simulations

✍ Scribed by Alessia Bacchi; Giancarlo Pelizzi

Book ID: 110258191
Publisher: Springer Netherlands
Year: 1999
Tongue: English
Weight: 164 KB
Volume: 13
Category: Article
ISSN: 0920-654X
DOI: 10.1023/a:1008070316079

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Comparison between self-guided Langevin

Comparison between self-guided Langevin dynamics and molecular dynamics simulations for structure refinement of protein loop conformations

✍ Mark A. Olson; Sidhartha Chaudhury; Michael S. Lee 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 687 KB

## Abstract This article presents a comparative analysis of two replica‐exchange simulation methods for the structure refinement of protein loop conformations, starting from low‐resolution predictions. The methods are self‐guided Langevin dynamics (SGLD) and molecular dynamics (MD) with a Nosé–Hoov

A Replica Exchange Molecular Dynamics Si

A Replica Exchange Molecular Dynamics Simulation of a Single Polyethylene Chain: Temperature Dependence of Structural Properties and Chain Conformational Study at the Equilibrium Melting Temperature

✍ Li, Ting; Yang, Xiaozhen; Nies, Erik 📂 Article 📅 2010 🏛 American Chemical Society 🌐 English ⚖ 821 KB

Analysis of the RGD sequence in protein

Analysis of the RGD sequence in protein structures: comparison to the conformations of the RGDW and DRGDW peptides determined by molecular dynamics simulations

✍ Roland H. Stote 📂 Article 📅 2001 🏛 Springer 🌐 English ⚖ 210 KB

Molecular Dynamics Simulations Combined

Molecular Dynamics Simulations Combined with Large Angle X-ray Scattering Technique for the Determination of the Structure, Conformation, and Conformational Dynamics of Polyphosphazenes in Amorphous Phase: Study of Poly[di(4-methylphenoxy)phosphazene]

✍ Caminiti, Ruggero; Gleria, Mario; Lipkowitz, Kenny B.; Lombardo, Giuseppe M.; Pa 📂 Article 📅 1997 🏛 American Chemical Society 🌐 English ⚖ 246 KB

Molecular Dynamics Simulation of DNA Str

Molecular Dynamics Simulation of DNA Stretching Is Consistent with the Tension Observed for Extension and Strand Separation and Predicts a Novel Ladder Structure

✍ Konrad, Michael W.; Bolonick, Joel I. 📂 Article 📅 1996 🏛 American Chemical Society 🌐 English ⚖ 198 KB

Transition-metal complexes with bidentat

Transition-metal complexes with bidentate ligands spanning trans-positions. Part XVIII. Crystal and molecular structure of the ligands 2,11-bis(di-R-phosphinomethyl)benzo[c]phenanthrene (R = Phenyl, tert-Butyl) and a comparison of their conformation in a variety of complexes

✍ Hans-Beat Bürgi; Judith Murray-Rust; Mercedes Camalli; Francesco Caruso; Luigi M 📂 Article 📅 1989 🏛 John Wiley and Sons 🌐 German ⚖ 439 KB 👁 1 views

The X-ray crystal structures of 2,1l-bis(di-R-phosphinomethyl)benzo[c]phenanthrenes (R = Ph, t -Bu) are reported. Both ligands have the same conformation and the substitution of a Ph by a t -Bu group does not cause significant changes in the tetracyclic aromatic unit which shows the same distortions