Optimizing the atom types of proteins through iterative knowledge-based potentials
(color online) Comparison of the derived pair potentials of [O2–]–[N2+] for different atom typing schemes with 1 to 20 atom types.
Optimizing the atom types of proteins through iterative knowledge-based potentials |
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(color online) Comparison of the derived pair potentials of [O2–]–[N2+] for different atom typing schemes with 1 to 20 atom types. |
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