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Molecular dynamics simulations

โœ Scribed by Tomas Hansson; Chris Oostenbrink; WilfredF van Gunsteren


Book ID
114314496
Publisher
Elsevier Science
Year
2002
Tongue
English
Weight
67 KB
Volume
12
Category
Article
ISSN
0959-440X

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Molecular dynamics simulations are now commonly applied to metalloproteins, despite the challenges introduced by the presence of metal ions. Force field parameters are nowadays available also for these 'exotic' atoms and several biological systems have been successfully studied. Some of the most rel