A Hybrid Meta On-Top Functional for Multiconfiguration Pair-Density Functional Theory
10.10.2024
Ronith Lahoti · Dusty Carroll
The green synthesis of Zinc Oxide nanoparticles utilizing Camellia Sinensis var. Assamica found in commercial tea dust, and their broad spectrum antibacterial activity
10.10.2024
Stephanie Norsikian · Baptiste Schelle et al.
Fast and Effective Preparation of Highly Cytotoxic Hybrid Molecules of Schweinfurthin E and OSW-1
10.10.2024
Longkun Xu · Mingwei Ge et al.
TADF-GEN: An Iterative and Self-improving
Method with Long-term Memory and Dynamic
Similarity Weight for Generating Thermally
Activated Delayed Fluorescence (TADF)
Molecules
10.10.2024
Alexey Ignatchenko
Launching Graphene into 3D-Space: Symmetry, Topology, and Strategies for Bottom-Up Synthesis of Schwarzites
10.10.2024
Aileen Y. Sun · Carrie H. Lin et al.
Fabrication of Low-Cost, High-Resolution Open Capillary Microfluidics towards Self-Sustaining, Long-Term Hydration of Engineered Living Materials
10.10.2024
Mario Patrick Wiesenfeldt · Benjamin R. G. Bissinger et al.
Z-Selective Alkyne Transfer Semihydrogenation in Drug-Like Molecules via an Organic Photoreductant
10.10.2024
Finlay Clark · Daniel Cole et al.
Robust Automated Equilibration Detection for Molecular Simulations
10.10.2024
Cailum Stienstra · Emir Nazdrajić et al.
From Reverse Phase Chromatography to HILIC: Graph Trans-formers Power Method-Independent Machine Learning of Retention Times
10.10.2024
Lichang Wang · Ruitao Wu et al.
Tautomerization Between Vinyl Alcohol and Acetaldehyde During Catalytic Ethanol Oxidation: The Effect of Water Molecules
10.10.2024
Donald Truhlar · Jie J. Bao et al.
A Hybrid Meta On-Top Functional for Multiconfiguration Pair-Density Functional Theory
10.10.2024
Ronith Lahoti · Dusty Carroll
The green synthesis of Zinc Oxide nanoparticles utilizing Camellia Sinensis var. Assamica found in commercial tea dust, and their broad spectrum antibacterial activity
10.10.2024
Stephanie Norsikian · Baptiste Schelle et al.
Fast and Effective Preparation of Highly Cytotoxic Hybrid Molecules of Schweinfurthin E and OSW-1
10.10.2024
Longkun Xu · Mingwei Ge et al.
TADF-GEN: An Iterative and Self-improving
Method with Long-term Memory and Dynamic
Similarity Weight for Generating Thermally
Activated Delayed Fluorescence (TADF)
Molecules
10.10.2024
Alexey Ignatchenko
Launching Graphene into 3D-Space: Symmetry, Topology, and Strategies for Bottom-Up Synthesis of Schwarzites
10.10.2024
Aileen Y. Sun · Carrie H. Lin et al.
Fabrication of Low-Cost, High-Resolution Open Capillary Microfluidics towards Self-Sustaining, Long-Term Hydration of Engineered Living Materials
10.10.2024
Mario Patrick Wiesenfeldt · Benjamin R. G. Bissinger et al.
Z-Selective Alkyne Transfer Semihydrogenation in Drug-Like Molecules via an Organic Photoreductant
10.10.2024
Finlay Clark · Daniel Cole et al.
Robust Automated Equilibration Detection for Molecular Simulations
10.10.2024
Cailum Stienstra · Emir Nazdrajić et al.
From Reverse Phase Chromatography to HILIC: Graph Trans-formers Power Method-Independent Machine Learning of Retention Times
10.10.2024
Lichang Wang · Ruitao Wu et al.
Tautomerization Between Vinyl Alcohol and Acetaldehyde During Catalytic Ethanol Oxidation: The Effect of Water Molecules