Results 181 to 190 of about 5,841 (257)

Commutative Algebra Modeling in Materials Science - A Case Study on Metal-Organic Frameworks (MOFs). [PDF]

J Chem Inf Model
Khaemba CS, Feng H, Chen D, Chen CL, Wei GW, Wei GW.   +5 more
europepmc   +1 more source

A Theoretical Investigation on the Hydrogen Bond Based on the GLED Method of Bonding Analysis

Journal of Computational Chemistry, Volume 47, Issue 7, March 15, 2026.
The 3D plot of the H(r) = 0 isosurface visually signals the noncovalent (nCov), weakly covalent (wCov), or polar covalent [Cov(pol)] character of neutral and ionic hydrogen‐bonded complexes. The increased degree of covalency mirrors an increased strength of the hydrogen bond (HB), which is classified based on the results of the bonding analysis ...
Stefano Borocci, Felice Grandinetti, Nico Sanna, Costantino Zazza   +3 more
wiley   +1 more source

Utility of Skin Patch Testing to Investigate Cardiac Implant-Related Hypersensitivity. [PDF]

JACC Adv
Mahowald MK, Nan JZ, El Shaer A, Chavez-Ponce AN, Sartori-Valinotti JC, Davis DM, Alkhouli M.   +6 more
europepmc   +1 more source

The Mining Industries, 1899-1939: A Study of Output, Employment, and Productivity [PDF]

Harold Barger, Sam H. Schurr
core  

Wavelength Dependence of fs Laser Ablation Ionisation Mass Spectrometry: a Dedicated Study on NIST SRM 664

Rapid Communications in Mass Spectrometry, Volume 40, Issue 5, 15 March 2026.
ABSTRACT Rationale Laser ablation mass spectrometry provides fast and direct chemical information of solids with high spatial resolution without the need for complex sample preparation. It has been shown that reducing the laser pulse length below picoseconds improves the quantification of chemical composition measurements of solids. This study compares
Valentine Grimaudo, Andreas Riedo, Marek Tulej, Peter Wurz   +3 more
wiley   +1 more source

Zinc Oxide-Graphitic Carbon Nitride Composites: Synthesis, Properties, and Application Scopes in Environmental Remediations. [PDF]

Small
Asghar H, Saeed M, Mirsafi FS, Ismael MK, Leißner T, Mishra YK.   +5 more
europepmc   +1 more source

Exploring the Therapeutic Potential of Cannabidiol in Cutaneous Squamous Cell Carcinoma: An Integrated Computational and Experimental Study

International Journal of Quantum Chemistry, Volume 126, Issue 5, March 5, 2026.
Cannabidiol (CBD) exhibits increased reactivity, stronger CB1 receptor binding, and enhanced cytotoxicity against A431 squamous carcinoma cells compared to 5‐fluorouracil (5‐FU). Integrated DFT, molecular docking, and experimental analyses demonstrate CBD's improved stability and binding affinity, highlighting its potential as an alternative ...
Andrea Jess Josiah, Krishna Kuben Govender, Penny Poomani Govender, Werner Cordier, Margo Nell, Suprakas Sinha Ray   +5 more
wiley   +1 more source

Unraveling the influence mechanisms of different substituents on the chemical activity of N-heterocyclic phosphines via theoretical calculations. [PDF]

J Mol Model
Chen Y.
europepmc   +1 more source

Output, Input, and Productivity Measurement [PDF]

Francis T. Christy, Jr, Neal Potter
core  

Nanoparticle-specific transformations dictate nanoparticle effects associated with plants and implications for nanotechnology use in agriculture. [PDF]

Nat Commun
Wei L, Liu J, Jiang G.
europepmc   +1 more source