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DL_POLY_3: the CCP5 national UK code for molecular-dynamics simulations

I T Todorov1, W Smith

  • 1Computational Science and Engineering Department, CCLRC Daresbury Laboratory, Daresbury, Warrington WA4 4AD, UK. i.t.todorov@dl.ac.uk

Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences
|August 13, 2004
PubMed

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