Results 181 to 190 of about 11,633 (209)

Newer Directions in QSAR/QSPR

2015
The QSAR/QSPR technique is now a widely practiced tool in chemical research both in the industry and academia. Because of the enormous potential applications of predictive modeling analysis, various newer methods have recently been developed to improve the usefulness and applicability of QSAR techniques.
Kunal Roy, Supratik Kar, Rudra Narayan Das   +2 more
openaire   +1 more source

Sinteza i QSPR estera gemfibrozila

1999
Sintetiziran je niz potencijalnih prolijekova gemfibrozila (Gem), ljekovite tvari iz skupine antihiperlipemika, s ciljem poboljšanja njegovih farmakokinetskih svojstava. Prolijekovi esterskog tipa pripravljeni su preko aktiviranog derivata gemfibrozila, benzotriazolida gemfibrozila (GEM-Bt) u reakciji s razlićitim alkoholima, uz dodatak trietilamina ...
Lovrek, Monika, Jadrijević-Mladar Takač, MIlena, Zorc, Branka, Butula, Ivan   +3 more
openaire   +2 more sources

IL QC QSPR - Preliminary Results

2004
Abstract : Partial contents: QSPR, Property(descriptor), Constraints/Goals, Cation Families Summarized, Structures, Surface Electrostatic Potential, Surface Electrostatic Potential, Descriptors, Separation and Interaction Energy, QSPR Correlation, Concluding(Open) Question.
openaire   +1 more source

QSPR

2022
openaire   +1 more source

QSPR studij novosintetiziranih pirol ketona

2001
Piroli posjeduju antimikrobno, antileukemijsko, sedativno ali i antibiotsko djelovanje. Dobiveni rezultati su korišteni u QSPR analizi. Kao parametri u regresijskoj analizi korištena su fizikalno-kemijska svojstva i parametar lipofilnosti, log P.
Bilalović, Emira, Muratović, Samija, Medić-Šarić, Marica   +2 more
openaire   +1 more source

QSPR Study of Flavonoid Compounds

2005
Flavonoids are a group of compounds widely distributed in plants, and due to their polyphenolic structure on flavan nucleus they have significant antioxidant activity. In this work, several QSPR models in study of some physical-chemical properties have been investigated for group of 30 flavonoids.
Friščić, Josipa, Nikolić, Sonja, Medić-Šarić, Marica   +2 more
openaire   +1 more source

Degree-based topological indices on anticancer drugs with QSPR analysis

Heliyon, 2020
Shanmukha M C
exaly  

Core, Coating, or Corona? The Importance of Considering Protein Coronas in nano-QSPR Modeling of Zeta Potential

ACS Nano, 2023
Selvaraj Sengottiyan, Tomasz Puzyn
exaly  

QSAR/QSPR Revisited

2018
Alexander Golbraikh, Alexander Tropsha
openaire   +1 more source

Quantum-Chemical Descriptors in QSAR/QSPR Studies

Chemical Reviews, 1996
Mati Karelson
exaly