Molecular interpretation of pharmaceuticals' adsorption on carbon nanomaterials: theory meets experiments

D Veclani, M Tolazzi, A Melchior - Processes, 2020 - mdpi.com
The ability of carbon-based nanomaterials (CNM) to interact with a variety of pharmaceutical
drugs can be exploited in many applications. In particular, they have been studied both as …

The dark side of platinum based cytostatic drugs: From detection to removal

Y Roque-Diaz, M Sanadar, D Han, M López-Mesas… - Processes, 2021 - mdpi.com
The uncontrolled release of pharmaceutical drugs into the environment raised serious
concerns in the last decades as they can potentially exert adverse effects on living …

Using theory to reinterpret the kinetics of monofunctional platinum anticancer drugs: stacking matters

D Veclani, A Melchior, M Tolazzi… - Journal of the …, 2018 - ACS Publications
The monofunctional platinum drug phenanthriplatin (phenPt) blocks the replication of cancer
cells even if it reacts with only one guanine base. However, there is still insufficient …

Complexation of uranium (VI) with glutarimidoxioxime: thermodynamic and computational studies

F Endrizzi, A Melchior, M Tolazzi, L Rao - Dalton Transactions, 2015 - pubs.rsc.org
The complex formation between a cyclic ligand glutarimidoxioxime (denoted as HLIII in this
paper) and UO22+ is studied by potentiometry and microcalorimetry. Glutarimidoxioxime …

Cyclic metal (oid) clusters control platinum-catalysed hydrosilylation reactions: from soluble to zeolite and MOF catalysts

M Rivero-Crespo, J Oliver-Meseguer, K Kapłońska… - Chemical …, 2020 - pubs.rsc.org
The Pt-catalysed addition of silanes to functional groups such as alkenes, alkynes,
carbonyls and alcohols, ie the hydrosilylation reaction, is a fundamental transformation in …

Which one among the Pt-containing anticancer drugs more easily forms monoadducts with G and A DNA bases? A comparative study among oxaliplatin, nedaplatin …

ME Alberto, V Butera, N Russo - Inorganic Chemistry, 2011 - ACS Publications
The platination processes of DNA bases with second-and third-generation Pt (II) anticancer
drugs have been investigated using density functional theory (DFT) combined with the …

Intercalation ability of novel monofunctional platinum anticancer drugs: a key step in their biological action

D Veclani, M Tolazzi, JP Cerón-Carrasco… - Journal of Chemical …, 2021 - ACS Publications
Phenanthriplatin (PtPPH) is a monovalent platinum (II)-based complex with a large
cytotoxicity against cancer cells. Although the aqua-activated drug has been assumed to be …

Cu (i) and Ag (i) complex formation with the hydrophilic phosphine 1, 3, 5-triaza-7-phosphadamantane in different ionic media. How to estimate the effect of a …

F Endrizzi, P Di Bernardo, PL Zanonato, F Tisato… - Dalton …, 2017 - pubs.rsc.org
The complexes of Cu (I) and Ag (I) with 1, 3, 5-triaza-7-phosphadamantane (PTA) are
currently studied for their potential clinical use as anticancer agents, given the cytotoxicity …

Raman and infrared spectroscopy, DFT calculations, and vibrational assignment of the anticancer agent picoplatin: performance of long-range corrected/hybrid …

M Malik, R Wysokiński, W Zierkiewicz… - The Journal of …, 2014 - ACS Publications
Picoplatin, cis-[PtCl2 (NH3)(2-picoline)], is a new promising anticancer agent undergoing
clinical trials, which reveals high efficacy against many tumors and greatly reduced toxicity …

Hydration of two cisplatin aqua-derivatives studied by quantum mechanics and molecular dynamics simulations

A Melchior, M Tolazzi, JM Martínez… - Journal of chemical …, 2015 - ACS Publications
The hydration of the cisplatin aqua-derivatives, cis-[PtCl (H2O)(NH3) 2]+(w-cisplatin) and cis-
[Pt (H2O) 2 (NH3) 2] 2+(w2-cisplatin), has been studied by means of classical molecular …