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[ASAP] Relating Model Performance to Embedding Distributions in Molecular Machine Learning

Research
Journal of Chemical Information and ModelingDOI: 10.1021/acs.jcim.6c00218 Source: http://dx.doi.org/10.1021/acs.jcim.6c00218

[ASAP] Hydrogen-Bonding Changes Cause Differences in Imipenem Breakdown Activity in OXA-48 Variants

Research
Journal of Chemical Information and ModelingDOI: 10.1021/acs.jcim.6c00223 Source: http://dx.doi.org/10.1021/acs.jcim.6c00223

[ASAP] Selected Configuration Interaction Using Time-Evolved Population Statistics

Research
Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.5c01994 Source: http://dx.doi.org/10.1021/acs.jctc.5c01994

[ASAP] Metabolic Trojan Horse: Multivalent Glucose Ligand Modified Near-Infrared-Absorbing Gold Nanorods for Targeted Photothermal Therapy

Research
ACS Applied Materials & InterfacesDOI: 10.1021/acsami.5c25469 Source: http://dx.doi.org/10.1021/acsami.5c25469

[ASAP] Single-Step Aerosol-Assisted Plasma Deposition of Biocomposite Glucose Oxidase/Poly(ethylene oxide) Films for Biosensing Applications

Research
ACS Applied Materials & InterfacesDOI: 10.1021/acsami.6c00923 Source: http://dx.doi.org/10.1021/acsami.6c00923

[ASAP] An Experimental Design for Pharmacy Undergraduates: Applying Conductometric Methods to Study the Kinetics of Aspirin Alkaline Hydrolysis

Research
Journal of Chemical EducationDOI: 10.1021/acs.jchemed.5c00683 Source: http://dx.doi.org/10.1021/acs.jchemed.5c00683

[ASAP] Modulating the Spatial Configuration of Bromine in Zinc-Based Covalent Organic Frameworks for Boosting Cocatalyst-Free CO2 Cycloaddition

Research
ACS Materials LettersDOI: 10.1021/acsmaterialslett.6c00208 Source: http://dx.doi.org/10.1021/acsmaterialslett.6c00208

[ASAP] Phase Equilibrium of the RbCl–RbBr–H2O System at 298.15 K and Molecular Dynamics Simulations of MCl–MBr–H2O (M = Li+, Na+, K+, Rb+, NH4+)

Research
Journal of Chemical & Engineering DataDOI: 10.1021/acs.jced.6c00096 Source: http://dx.doi.org/10.1021/acs.jced.6c00096

Citrine Informatics and Perstorp Partner to Accelerate Alkyd Emulsion Innovation Using AI

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Research
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.5c07760 Source: http://dx.doi.org/10.1021/acs.jpca.5c07760

Night and (Earth) Day

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This image, released in celebration of Earth Day, shows the terminator – the line between night and day – on Earth. The Artemis II...

[ASAP] Representations of the Nature of Science in Curriculum Goals of China’s Chemistry Curriculum Standards: A Cross-Edition Comparison (2001–2022)

Research
Journal of Chemical EducationDOI: 10.1021/acs.jchemed.5c00766 Source: http://dx.doi.org/10.1021/acs.jchemed.5c00766
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