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Original paper

Theoretical Studies on the Molecular Properties, Toxicity, and Biological Efficacy of 21 New Chemical Entities

Volume: 6, Issue: 38, Pages: 24891 - 24901
Published: Sep 15, 2021
Abstract
New chemical entities (NCEs) such as small molecules and antibody-drug conjugates have strong binding affinity for biological targets, which provide deep insights into structure-specific interactions for the design of future drugs. As structures of drugs increase in complexity, the importance of computational predictions comes into sharp focus. Knowledge of various computational tools enables us to predict the molecular properties, toxicity, and...
Paper Details
Title
Theoretical Studies on the Molecular Properties, Toxicity, and Biological Efficacy of 21 New Chemical Entities
Published Date
Sep 15, 2021
Journal
Volume
6
Issue
38
Pages
24891 - 24901
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