Results 151 to 160 of about 663,798 (288)
Advanced Functional Materials, EarlyView.HKUST‐1/TiO2 composite materials show a very high photocatalytic hydrogen evolution rate which increases as a function of the irradiation time until reaching a plateau and even surpasses the performance of the 1%Pt/TiO2 material after three photocatalytic cycles.
Alisha Khan +9 more
wiley +1 more source
Computational Chemistry Advances in the Development of PARP1 Inhibitors for Breast Cancer Therapy. [PDF]
Pharmaceuticals (Basel)Twala C, Govender P, Govender K.
europepmc +1 more source
Theoretical Investigations of 2 H ‐Iminopyran Derivatives: A Computational Chemistry Approach [PDF]
P.L. Sharma, Pragya Sinha
openalex +1 more source
Beyond static structures: Putting forth REMD as a tool to solve problems in computational organic chemistry [PDF]
, 2015 Riccardo Petraglia +4 more
openalex +1 more source
Atomic Size Misfit for Electrocatalytic Small Molecule Activation
Advanced Functional Materials, EarlyView.This review explores the application and mechanisms of atomic size misfit in catalysis for small molecule activation, focusing on how structural defects and electronic properties can effectively lower the energy barriers of chemical bonds in molecules like H2O, CO2, and N2.
Ping Hong +3 more
wiley +1 more source
Unraveling the thermal decomposition and chemical ionization of methionine using ion mobility spectrometry and computational chemistry. [PDF]
Sci RepAmiri M +3 more
europepmc +1 more source
Bioinformatics and computational chemistry approaches to explore the mechanism of the anti-depressive effect of ligustilide. [PDF]
Sci Rep, 2023 Zhang K +4 more
europepmc +1 more source