Results 141 to 150 of about 6,707 (205)

Multi-criteria decision analysis of dendrimer applications in drug delivery systems. [PDF]

Eur Phys J E Soft Matter
Bibi Z, Ghafar MS, Ali Y, Imran M, Shang Y.   +4 more
europepmc   +1 more source

From graph theory to chemoinformatics: modified bond-based indices and a hypothesis-driven multi-task QSAR/QSPR benchmark. [PDF]

Sci Rep
Altairi A, Alhaj Z, Alsharafi M, Zeren Y.   +3 more
europepmc   +1 more source

Spectral energies of redefined Zagreb indices and comparative QSPR applications to anticancer and alcohol datasets. [PDF]

Sci Rep
Zeren Y, Çiçek E, Alsharafi M.
europepmc   +1 more source

Enhancing bioinformatics engineering by utilizing graph therapeutic properties for clinically approved antitoxin drugs in zoonotic diseases. [PDF]

Sci Rep
Imran M, Aqib M, Malik MA, Jutt S.
europepmc   +1 more source

Machine learning-based QSPR modeling for predicting the <i>n</i>-octanol/air partition coefficient of polybrominated diphenyl ethers. [PDF]

iScience
Wu W, Chen H, Liu Z, Yan W, Wu D, Chen J, Liu J, Xing Z.   +7 more
europepmc   +1 more source

Integrating fuzzy logic and neural networks with multi-criteria decision-making for intelligent evaluation of drug compound design attributes. [PDF]

Sci Rep
Ahmed W, Zaman S, Abd-Elmonem A, Siddig NAA, Belay MB.   +4 more
europepmc   +1 more source

Use of Three-Dimensional Molecular Descriptors to Predict the Glass Transition Temperature of Polymers. [PDF]

Polymers (Basel)
Jr HLO, Andrade MP, Lazzari LK, Zattera AJ.   +3 more
europepmc   +1 more source

Predictive modeling for physicochemical properties of β-lactam antibiotics through eigenvalue based topological indices and non linear regression techniques. [PDF]

Sci Rep
Yuvaraj A, Kalaimurugan G, Thamizhmaran R, Tajudeen MM, Contreras RC.   +4 more
europepmc   +1 more source

Interpreting Molecular Descriptors for Glass Transition Temperature Prediction and Design of Polyimides. [PDF]

Materials (Basel)
Cui T, Liu H, Liu X, Min Y.
europepmc   +1 more source