Results 191 to 200 of about 141,530 (234)
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Current Cancer Drug Targets, 2022
BACKGROUND In the last decade, cancer has been a leading cause of death worldwide. Despite the impressive progress in cancer therapy, firsthand treatments are not selective to cancer cells and cause serious toxicity.
Nidia del Carmen Quintal Bojórquez +1 more
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BACKGROUND In the last decade, cancer has been a leading cause of death worldwide. Despite the impressive progress in cancer therapy, firsthand treatments are not selective to cancer cells and cause serious toxicity.
Nidia del Carmen Quintal Bojórquez +1 more
semanticscholar +1 more source
Computer-aided drug design in seeking viral capsid modulators.
Drug Discovery Today, 2023Approved or licensed antiviral drugs have limited applications because of their drug resistance and severe adverse effects. By contrast, by stabilizing or destroying the viral capsid, compounds known as capsid modulators prevent viral replication by ...
Shujie Zhao +4 more
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2021
The long-used traditional methodology for novel drug discovery and drug development is an immensely challenging, multifaceted, and prolonged process. To overcome this limitation, a new advanced approach was developed and adopted over time which is referred to as computer-aided drug discovery (CADD).
Thakor Rajkishan +4 more
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The long-used traditional methodology for novel drug discovery and drug development is an immensely challenging, multifaceted, and prolonged process. To overcome this limitation, a new advanced approach was developed and adopted over time which is referred to as computer-aided drug discovery (CADD).
Thakor Rajkishan +4 more
openaire +1 more source
Combinatorial chemistry & high throughput screening
Computer-Aided Drug Design (CADD) entails designing molecules that could potentially interact with a specific biomolecular target and promising their potential binding.
Benjamin Siddiqui +10 more
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Computer-Aided Drug Design (CADD) entails designing molecules that could potentially interact with a specific biomolecular target and promising their potential binding.
Benjamin Siddiqui +10 more
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Computer-Aided drug design of new 2-amino-thiophene derivatives as anti-leishmanial agents.
European journal of medicinal chemistry, 2023The leishmaniasis is a neglected disease caused by a group of protozoan parasites from the genus Leishmania whose treatment is limited, obsolete, toxic, and ineffective in certain cases.
I. Luna +6 more
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Annual Review of Pharmacology and Toxicology, 1987
Progress in genetic engineering has increased the need for, while advances in computational hardware have removed barriers impeding, the development of appropriate computational tools to assist in the understanding of molecular interactions. Advancements both in techniques and in broadening application have been clearly demonstrated.
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Progress in genetic engineering has increased the need for, while advances in computational hardware have removed barriers impeding, the development of appropriate computational tools to assist in the understanding of molecular interactions. Advancements both in techniques and in broadening application have been clearly demonstrated.
openaire +2 more sources
2021
Computer-Aided Drug Design topic deals with the application of computer hardware and software to provide solutions at every stage of drug discovery. QSAR methods help in evaluating the data emerging from pharmacology laboratories. The molecular docking methods provide atomic-level information regarding the interaction between drugs and macromolecules ...
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Computer-Aided Drug Design topic deals with the application of computer hardware and software to provide solutions at every stage of drug discovery. QSAR methods help in evaluating the data emerging from pharmacology laboratories. The molecular docking methods provide atomic-level information regarding the interaction between drugs and macromolecules ...
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Recent Advances in Computer Aided Drug Design
Current Topics in Medicinal Chemistry, 2023Riccardo, Concu +2 more
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Update on computer-aided drug design
Current Opinion in Biotechnology, 1995Recent advances in computational methods for drug design include developments in quantitative structure-activity relationship approaches as well as novel structure-based strategies. Many new protein structures of pharmaceutical interest have been solved, a number of which contain a bound inhibitor. Continued progress has been reported in algorithms for
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Journal of Biomolecular Structure and Dynamics, 2023
Microtubule affinity regulating kinase (MARK4) has been proposed as a potential therapeutic target for diabetes, cancer, and neurological diseases. We used a variety of computational studies techniques to examine the binding affinity and MARK4 inhibitory
Riyadh Ahmed +8 more
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Microtubule affinity regulating kinase (MARK4) has been proposed as a potential therapeutic target for diabetes, cancer, and neurological diseases. We used a variety of computational studies techniques to examine the binding affinity and MARK4 inhibitory
Riyadh Ahmed +8 more
semanticscholar +1 more source