COMMENT ON MOLECULAR-DYNAMICS SIMULATIONS OF ZINC IONS IN WATER USINGCHARMM

Authors
OBST S STOTE RH
Citation
S. Obst et Rh. Stote, COMMENT ON MOLECULAR-DYNAMICS SIMULATIONS OF ZINC IONS IN WATER USINGCHARMM, JOURNAL OF MOLECULAR MODELING, 4(4), 1998, pp. 145-146
Citations number
7
Categorie Soggetti
Biophysics,Biology,Chemistry,"Computer Science Interdisciplinary Applications
Journal title
JOURNAL OF MOLECULAR MODELING
ISSN journal
16102940 → ACNP
Volume
4
Issue
4
Year of publication
1998
Pages
145 - 146
Database
ISI
SICI code
1610-2940(1998)4:4<145:COMSOZ>2.0.ZU;2-0
Abstract
In the recent paper by Obst and Bradaczek [1], which compares two sets of force field parameters for divalent zinc, several errors were made . Clarifying these errors leads to another interpretation of their sim ulation results, which, in contrast to their original conclusions, sub stantiates the parameter set for zinc ion developed by Stote and Karpl us [2].