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Biological and Medicinal Chemistry

Working Paper

A Drug Repurposing Approach to Identify Therapeutics by Screening Medicines for Malaria Ventures Exploiting SARS-CoV-2 Main Protease

Rashmi Tyagi, Anubrata Paul, V. Samuel Raj, Krishna Kumar Ojha, Manoj Kumar Yadav

Version 1 posted 18 January 2021

635

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Biological and Medicinal Chemistry

Working Paper

Carbon Monoxide Chemistry of a-V70I Mo-Nitrogenase: Evidence from EPR- and IR-Monitored Photolysis - or, what a Difference a Methyl Makes

Simon George, Leland Gee, Aubrey Scott, Lance Seefeldt, Stephen Cramer

Version 1 posted 16 May 2025

0

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Materials Chemistry

Working Paper

Mesoporous Frameworks Assembled from Amphiphilic Collagen-Mimetic Peptides

Anthony Perez, Jianfang Liu, Adekunle Adewole, Gang Ren, Andrea Merg

Version 1 posted 16 May 2025

0

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Physical Chemistry

Working Paper

Understanding Equilibrium Size Distribution of Metal Single Atoms, Clusters, and Particles from Thermodynamics

Zhaoming Xia, Cong-Qiao Xu, Jun Li

Version 1 posted 16 May 2025

0

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Materials Chemistry

Working Paper

Heavy metal-free visible-to-UV photon upconversion with over 20% efficiency sensitized by a ketocoumarin derivative

Masanori Uji, Naoyuki Harada, Nobuo Kimizuka, Nobuhiro Yanai

Version 1 posted 16 November 2021

721

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Catalysis

Working Paper

Multiple C-C bond formation upon electrocatalytic reduction of CO2 by a molecular catalyst

Si-Thanh DONG, Chen Xu, Benedikt Lassalle-Kaiser

Version 1 posted 20 September 2021

437

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Inorganic Chemistry

Working Paper

A Computational Protocol to Calculate the Phosphorescence Energy of Pt (II) Complexes: Is the lowest triplet excited state always involved in emission? A Comprehensive Benchmark Study

Prashant Kumar, Daniel Escudero

Version 1 posted 24 August 2021

722

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Physical Chemistry

Working Paper

Modelling the effects of E/Z photoisomerization of a cyclocurcumin analogue on the properties of cellular lipid membranes

Anastasiia Delova, Raul Losantos, Jéremy Pecourneau, Maxime Mourer, Andreea Pasc, Antonio Monari

Version 1 posted 30 May 2023

168

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Theoretical and Computational Chemistry

Working Paper

VSFlow: an open-source ligand-based virtual screening tool

Sascha Jung, Helge Vatheuer, Paul Czodrowski

Version 1 posted 24 May 2022

1,284

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Materials Chemistry

Working Paper

Organic Near Infrared Photothermal Materials with Temperatures up to 450 oC Constructed by Cycloaddition-Retroelectrocyclization Click Reaction

Pengbo Han, Guiquan Zhang, He Xu, Rong Hu, Anjun Qin, Ben Zhong Tang

Version 1 posted 12 August 2022

454

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1

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A Drug Repurposing Approach to Identify Therapeutics by Screening Medicines for Malaria Ventures Exploiting SARS-CoV-2 Main Protease

Carbon Monoxide Chemistry of a-V70I Mo-Nitrogenase: Evidence from EPR- and IR-Monitored Photolysis - or, what a Difference a Methyl Makes

Mesoporous Frameworks Assembled from Amphiphilic Collagen-Mimetic Peptides

Understanding Equilibrium Size Distribution of Metal Single Atoms, Clusters, and Particles from Thermodynamics

Heavy metal-free visible-to-UV photon upconversion with over 20% efficiency sensitized by a ketocoumarin derivative

Multiple C-C bond formation upon electrocatalytic reduction of CO2 by a molecular catalyst

A Computational Protocol to Calculate the Phosphorescence Energy of Pt (II) Complexes: Is the lowest triplet excited state always involved in emission? A Comprehensive Benchmark Study

Modelling the effects of E/Z photoisomerization of a cyclocurcumin analogue on the properties of cellular lipid membranes

VSFlow: an open-source ligand-based virtual screening tool

Organic Near Infrared Photothermal Materials with Temperatures up to 450 oC Constructed by Cycloaddition-Retroelectrocyclization Click Reaction