An Automated Force Field Topology Builder (ATB) and Repository: Version 1.0

Journal of Chemical Theory and Computation - Tập 7 Số 12 - Trang 4026-4037 - 2011
Alpeshkumar K. Malde1, Le Zuo1, Matthew Breeze1, Martin Stroet1, David Poger1, Pramod C. Nair1, Chris Oostenbrink2,3, Alan E. Mark4,1
1School of Chemistry and Molecular Biosciences, University of Queensland, St. Lucia, Australia
2Institute of Molecular Modeling and Simulation, University of Natural Resources and Life Sciences, Vienna, Austria
3Leiden/Amsterdam Center for Drug Research, Division of Molecular Toxicology, Vrije Universiteit Amsterdam , Amsterdam, The Netherlands.
4Institute for Molecular Bioscience, University of Queensland, St. Lucia, QLD 4072, Australia

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