Results 111 to 120 of about 22,128,804 (198)

QSPR analysis for fluorescent properties of imidazole and pyrimidine derivatives

, 2017
У роботі було модифіковано метод аналізу, побудована консенсусна QSPR модель методом PLS на 20-рівні представлення молекулярної структури, що відображує залежність структура-властивість. Проведений дизайн молекул, для яких було проведено прогнозування
Стельмах, Сергій Ігорович
core   +1 more source

Sarveiskalvon permeabiliteetin ennustaminen QSPR-mallin avulla

, 2011
QSPR (Quantitive structure property relationship) describes relationship between descriptors and biological activity. Therefore, QSPR models are useful tools in drug discovery. The literature review summarizes existing corneal, intestinal and blood brain
Tissari, Anita
core  

Domination topological properties of polyhydroxybutyrate and polycaprolactone with QSPR analysis [PDF]

Nanosystems: Physics, Chemistry, Mathematics, 2021
Hanan Ahmed, Anwar Alwardi, Suha A. Wazzan   +2 more
openaire   +1 more source

Topological indices and QSPR analysis of drug molecules from different therapeutic classes. [PDF]

Sci Rep
Mufti ZS, Rubab UE, Alharthi AM, Ganati GA.   +3 more
europepmc   +1 more source

Degree-based topological indices and their graph energies in the QSPR analysis and ranking of UV-filter compounds. [PDF]

Front Chem
Manuel M, Angamuthu P.
europepmc   +1 more source

Chromatic hyper Zagreb topological descriptors and QSPR analysis of certain skin cancer drugs. [PDF]

Front Chem
Pavithra R, Ravi Sankar J.
europepmc   +1 more source

QSPR analysis of the drugs used to treat major depressive disorder using degree and neighborhood degree based indices. [PDF]

Front Chem
Godlin JJJ, Radha S.
europepmc   +1 more source

Predictive performance and QSPR analysis of SARS-CoV-2 and tuberculosis drugs using distance-based topological descriptors. [PDF]

Sci Rep
Supriya, Iyer RR.
europepmc   +1 more source

Erratum to "Degree-based topological indices on anticancer drugs with QSPR analysis" [Heliyon 6 (6) (June 2020) e04235]. [PDF]

Heliyon, 2020
Shanmukha MC, Basavarajappa NS, Shilpa KC, Usha A.   +3 more
europepmc   +1 more source

Novel Roman domination-based graph energies for QSPR analysis of neuroprotective herbal compounds in Alzheimer's disease treatment. [PDF]

Front Chem
Salini Jancy Rani A, Balamurugan BJ.
europepmc   +1 more source