most citedBlue moon ensemble simulation of aquation free energy profiles applied to mono and bifunctional platinum anticancer drugs

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physics.chem-ph2020★ 1 cited

Blue moon ensemble simulation of aquation free energy profiles applied to mono and bifunctional platinum anticancer drugs

Teruo Hirakawa, David R. Bowler, Tsuyoshi Miyazaki +2

Aquation free energy profiles of neutral cisplatin and cationic monofunctional derivatives, including triaminochloroplatinum(II) and cis-diammine(pyridine)chloroplatinum(II), were…