Results 111 to 120 of about 11,478 (188)

Toward Environment-Sensitive Molecular Inference via Mixed Integer Linear Programming. [PDF]

ACS Omega
Zhu J, Takekida M, Azam NA, Haraguchi K, Zhao L, Akutsu T.   +5 more
europepmc   +1 more source

Lower bounds for the Zagreb indices of trees with given total domination number and its applications in QSPR studies of alkanes. [PDF]

Sci Rep
Manuel M, Parthiban A.
europepmc   +1 more source

Adsorption of the model drug testosterone on laboratory tips [PDF]

, 2007
Baert, Bram, Bodé, Samuel, De Spiegeleer, Bart   +2 more
core  

DFT based structural modeling of chemotherapy drugs via topological indices and curvilinear regression. [PDF]

Sci Rep
Saeed F, Idrees N, Imran M.
europepmc   +1 more source

Symmetry-guided monomer design enables the combinatorial synthesis and targeted screening of polyesters. [PDF]

Chem Sci
Feng X, He X, Zhu J, Lin LH, Shang Q, Luo ZH, Zhou YN, Yan F.   +7 more
europepmc   +1 more source

Novel eigenvector centrality indices for octane isomers to explore their physicochemical properties. [PDF]

Sci Rep
Rani ASJ, Balamurugan BJ.
europepmc   +1 more source

Topological insights into breast cancer drugs: a QSPR approach using resolving topological indices. [PDF]

Front Chem
Pandeeswari E, Ravi Sankar J.
europepmc   +1 more source

QSAR/QSPR and Proprietary Data [PDF]

Journal of Chemical Information and Modeling, 2006
openaire   +1 more source

Chemical significance and degeneracy of weighted degree-based topological descriptor second Davan index for octane isomers and computation of certain nanostructures. [PDF]

Sci Rep
Swapna BS, Chetana G, Shanmukha MC, Manjunath G, Usha A.   +4 more
europepmc   +1 more source

High-Resolution Mass Spectrometry Analysis of Legacy and Emerging PFAS in Oilfield Environments: Occurrence, Source, and Toxicity Assessment. [PDF]

Toxics
Sun X.
europepmc   +1 more source