Results 231 to 240 of about 4,458,384 (285)

Coupled Molecular and Framework Descriptors for Band-Edge Spin Splitting in Chiral Hybrid Organic-Inorganic Perovskites. [PDF]

J Am Chem Soc
Nabi M, Aucar JJ, Chen X, Aucar GA, Stroppa A.   +4 more
europepmc   +1 more source

A linear models approach to optimize carbazole-based dyes for solar cell applications. [PDF]

J Comput Aided Mol Des
Mattos EFDS, Daniel CRA, da Costa Júnior NB.   +2 more
europepmc   +1 more source

Benchmarking Classical and Quantum Machine Learning for Potency Prediction across Ten Therapeutically Relevant Targets. [PDF]

ACS Med Chem Lett
Garg S, Garg S.
europepmc   +1 more source

Interpretable QSPR Modeling of Bipolar Disorder Drugs Using Topological Indices and Machine Learning Regression. [PDF]

ACS Omega
Çolakoğlu Ö, Benjamin AJ.
europepmc   +1 more source

Experimental dipole moment prediction with a progressive 2D-3D hybrid framework and twin-pair-based diagnostic evaluation. [PDF]

J Cheminform
Ugurlu SY, He S.
europepmc   +1 more source

Soft Computing Approaches toward Density-Based Analysis of Many-Electron Systems. [PDF]

ACS Phys Chem Au
Poddar A, Chakraborty B, Chattaraj PK.
europepmc   +1 more source