Design of Two-Dimensional Functional Materials and Nanodevices

Guangzhao Wang, Xiaotian Wang, Yee Sin Ang, Junjie He, Zhaofu Zhang

Frontiers Media SA

Science Materials

Keywords: 2D materials,­heterostructures,­Nanodevices,­functional materials

Computational Methods for the Description of Intermolecular Interactions and Molecular Motion in Confining Environments

Heribert Reis, Piotr Żuchowski, Sonja Grubisic

Frontiers Media SA

Science Chemistry Theoretical and Computational Chemistry

Keywords: multi-scale molecular dynamics,­computational methods,­Molecular confinement,­Nuclear motion,­force field development

Celebrating the Work of Prof. Sourav Pal: Computational Approaches in Catalysis

Soumyajit Roy, Sailaja Krishnamurty, Wolfgang Schöfberger

Frontiers Media SA

Science Chemistry Physical Chemistry and Chemical Physics

Keywords: Catalysis,­Computational Chemistry,­Theoretical Chemistry,­Small molecule activation,­Methodology development

Novel Therapeutic Interventions Against Infectious Diseases: COVID-19

Sugunadevi Sakkiah, Keun Woo Lee, Chandrabose Selvaraj

Frontiers Media SA

Science Pharmacology Experimental Pharmacology and Drug Discovery

Keywords: COVID-19,­SARS-CoV-2,­Structure-based drug designing,­molecular docking,­Molecular dynamic simulation

Rising Stars: Africa

Tebello Nyokong, Aziz Amine, Emmanuel Oluwadare Balogun, Shivani Mishra, Eno E. Ebenso

Frontiers Media SA

Science Chemistry Electrochemistry

Keywords: Chemistry,­Africa

Women in Science: Chemistry

Jennifer L. Schaefer, Elisabeth Lojou, Svetlana Ivanova, Silvia Giordani, Qin Li

Frontiers Media SA

Science Chemistry Electrochemistry

Keywords: Chemistry,­Women,­stem,­diversity,­UNESCO,­International Day of Women and Girls in Science

Frontiers in Chemistry - Rising Stars: Asia

Jyotirmayee Mohanty, Hongyan Sun, Taner Yonar, Tsuyoshi Minami, Jafar Soleymani, Basem Moosa, Lei Guo, Qianxiong Zhou, Wukun Liu

Frontiers Media SA

Science Chemistry Astrochemistry

Keywords: Organic Chemistry,­nanocomposite,­Chemical Biology,­Sustainable Chemistry,­Biomolecular marker

Atomic Clusters: Theory & Experiments

Ambrish Kumar Srivastava, Iwona Anusiewicz, Neeraj Misra, Suzana Velickovic, Wei-Ming Sun

Frontiers Media SA

Science Chemistry Physical Chemistry and Chemical Physics

Keywords: atomic clusters,­Theory,­Superatom

Endemic Plants: Experimental and Theoretical Insights Into Properties of Bioactive Metabolites With Therapeutic Potential

Carolina Otero, Jorge Ignacio Martínez-Araya, Jorge M. del Campo

Frontiers Media SA

Science Chemistry Chemical Biology

Keywords: Bioactive metabolites,­Cellular target,­Docking,­QSAR,­Biological properties