Претрага

Резултати

Las Vegas algorithm in the prediction of intrinsic solubility of drug-like compounds [2025]

Veselinovic, Aleksandar M ; Toropova, Alla P; Toropov, Andrey A; Roncaglioni, Alessandra; Benfenati, Emilio

A theoretical study on ionization of sartans in aqueous media and on interactions with surfactant micelles [2018]

Popović-Nikolić, Marija ; Popović, Gordana ; Grujić, Maja; Nikolić, Katarina ; Agbaba, Danica

Prediction of hepatic microsomal intrinsic clearance and human clearance values for drugs [2009]

Nikolić, Katarina ; Agbaba, Danica

Effects of conjugation metabolism on radical scavenging and transport properties of quercetin – In silico study [2019]

Stepanić, Višnja; Matić, Sara; Amić, Ana; Lučić, Bono; Milenković, Dejan ; Marković, Zoran

Design and QSAR study of analogs of gamma-tocotrienol with enhanced anti proliferative activity against human breast cancer cells [2009]

Nikolić, Katarina ; Agbaba, Danica

In silico design of endothelin receptor antagonists using Monte Carlo-based QSAR modeling, molecular docking, and ADME profiling [2025]

Marinkovic, Marija; Nikolic, Nemanja; Nikolic, Tamara; Bozanic, Borislav; Topalovic, Marija; Rancic, Andrija; Sajnovic, Stefan; Veselinovic, Aleksandar M

Computational study of protein secondary structure elements: Ramachandran plots revisited [2014]

Carrascoza, Francisco; Zarić, Snežana D. ; Silaghi-Dumitrescu, Radu

The 3D-QSAR study of 110 diverse, dual binding, acetylcholinesterase inhibitors based on alignment independent descriptors (GRIND-2). The effects of conformation on predictive power and interpretability of the models [2012]

Vitorović-Todorović, Maja D. ; Cvijetić, Ilija ; Juranić, Ivan O.; Drakulić, Branko J.

Design and QSAR study of analogs of alpha-tocopherol with enhanced antiproliferative activity against human breast adenocarcinoma cells [2008]

Nikolić, Katarina

Prediction of toxicity and data exploratory analysis of estrogen-active endocrine disruptors using counter-propagation artificial neural networks [2010]

Stojić, Nataša ; Erić, Slavica ; Kuzmanovski, Igor