Search Results - "computational chemistry"

Computational Chemistry for the Identification of Lead Compounds for Radiotracer Development by Chia-Ju Hsieh, Sam Giannakoulias, E. James Petersson, Robert H. Mach

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Matrix metalloproteinases and their considerations in Dentistry from the field of computational chemistry by Antonio José Díaz Caballero, Darío Mendez Cuadro, Emiliano Rafael Martinez Serrano, Jennifer Orozco Páez, Margarita Rosa Velásquez Martínez

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Educational Computational Chemistry for In-Service Chemistry Teachers: A Data Mining Approach to E-Learning Environment Redesign by José Hernández-Ramos, Lizethly Cáceres-Jensen, Jorge Rodríguez-Becerra

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Constructing a Novel E-Learning Course, Educational Computational Chemistry through Instructional Design Approach in the TPASK Framework by José Hernández-Ramos, Jorge Rodríguez-Becerra, Lizethly Cáceres-Jensen, Maija Aksela

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Challenges in Computational Enzymology

Subjects: “…computational chemistry…”
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On the diverse bonding situations in nanostructures : an ab initio computational study by Pankewitz, Tobias

Subjects: “…computational chemistry…”
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Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design

Subjects: “…Computational Chemistry…”
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In Silico Methods for Drug Design and Discovery

Subjects: “…computational chemistry…”
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Frontiers in Chemistry: Rising Stars

Subjects: “…Theoretical and Computational Chemistry…”
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Recent Advances in Post-Lithium Ion Batteries

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Coordination Chemistry of Silicon by Inoue, Shigeyoshi

Subjects: “…computational chemistry…”
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Feature Papers in Compounds

Subjects: “…computational chemistry…”
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Video Demonstrations of a Benzene Derivative Reaction from Its Optimized Intermediate Structure by Jumaidil Awal, Muhamad Abdulkadir Martoprawiro

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Molecular Modelling by Aarti Sharma, Himanshu Gupta

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Electrochemical Characterization of Central Action Tricyclic Drugs by Voltammetric Techniques and Density Functional Theory Calculations by Edson Silvio Batista Rodrigues, Isaac Yves Lopes de Macêdo, Larissa Lesley da Silva Lima, Douglas Vieira Thomaz, Carlos Eduardo Peixoto da Cunha, Mayk Teles de Oliveira, Nara Ballaminut, Morgana Fernandes Alecrim, Murilo Ferreira de Carvalho, Bruna Guimarães Isecke, Karla Carneiro de Siqueira Leite, Fabio Bahls Machado, Freddy Fernandes Guimarães, Ricardo Menegatti, Vernon Somerset, Eric de Souza Gil

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Molecular modeling by Aarti Sharma, Himanshu Gupta

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Editorial: Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design by Leonardo L. G. Ferreira, Adriano D. Andricopulo

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How we Should Think About Drug Development by César Portela

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Discovering Photoswitchable Molecules for Drug Delivery with Large Language Models and Chemist Instruction Training by Junjie Hu, Peng Wu, Yulin Li, Qi Li, Shiyi Wang, Yang Liu, Kun Qian, Guang Yang

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Editorial: Computational chemogenomics: In silico tools in pharmacological research and drug discovery by Norberto Sánchez-Cruz, Norberto Sánchez-Cruz, Eli Fernandez-de Gortari, José L. Medina-Franco

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