Theoretical and computational analyses of LNG evaporator
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Thermal Science"
DOI: 10.1007/s11630-017-0921-z
Abstract: Theoretical and numerical analysis on the fluid flow and heat transfer inside a LNG evaporator is conducted in this work. Methane is used instead of LNG as the operating fluid. This is because; methane constitutes… read more here.
Keywords: theoretical computational; computational analyses; methane; analyses lng ... See more keywords
Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents
Sign Up to like & getrecommendations! Published in 2018 at "Journal of Biomolecular Structure and Dynamics"
DOI: 10.1080/07391102.2017.1404938
Abstract: Activin Receptor-Like Kinase 5 (ALK-5) is related to some types of cancer, such as breast, lung, and pancreas. In this study, we have used molecular docking, molecular dynamics simulations, and free energy calculations in order… read more here.
Keywords: analyses interactions; interactions alk; computational analyses; bioactive ligands ... See more keywords
Computational analyses of bacterial strains from shotgun reads
Sign Up to like & getrecommendations! Published in 2022 at "Briefings in bioinformatics"
DOI: 10.1093/bib/bbac013
Abstract: Shotgun sequencing is routinely employed to study bacteria in microbial communities. With the vast amount of shotgun sequencing reads generated in a metagenomic project, it is crucial to determine the microbial composition at the strain… read more here.
Keywords: computational analyses; bacterial strains; shotgun reads; strain ... See more keywords
Computational Analyses Reveal Fundamental Properties of the Hemophilia Literature in the Last 6 Decades
Sign Up to like & getrecommendations! Published in 2022 at "Bioinformatics and Biology Insights"
DOI: 10.1177/11779322221125604
Abstract: Hemophilia is an inherited blood coagulation disorder caused by mutations on the coagulation factors VIII or IX genes. Although it is a relatively rare disease, the research community is actively working on this topic, producing… read more here.
Keywords: hemophilia literature; computational analyses; literature last; reveal fundamental ... See more keywords
Discovery and Computational Analyses of Novel Small Molecule Zika Virus Inhibitors
Sign Up to like & getrecommendations! Published in 2019 at "Molecules"
DOI: 10.3390/molecules24081465
Abstract: Zika virus (ZIKV), one of the flaviviruses, has attracted worldwide attention since its large epidemics around Brazil. Association of ZIKV infection with microcephaly and neurological problems such as Guillain–Barré syndrome has prompted intensive pathological investigations.… read more here.
Keywords: computational analyses; analyses novel; novel small; zika virus ... See more keywords
Innovative Amino-Functionalization of Pyrido[2,3-d]pyrimidine Scaffolds for Broad Therapeutic Applications Supported by Computational Analyses
Sign Up to like & getrecommendations! Published in 2025 at "Pharmaceuticals"
DOI: 10.3390/ph18101472
Abstract: Background: Derivatives of Pyrido[2,3-d]pyrimidine-6-carboxylate are promising multi-target scaffolds. This study focused on synthesizing 16 amino-functionalized derivatives and evaluating their dual anticancer and antibacterial activities, supported by mechanistic and computational analyses. Objectives: Design and synthesize derivatives,… read more here.
Keywords: antibacterial activity; pyrido pyrimidine; molecular dynamics; computational analyses ... See more keywords
Green by Design: Convergent Synthesis, Computational Analyses, and Activity Evaluation of New FXa Inhibitors Bearing Peptide Triazole Linking Units
Sign Up to like & getrecommendations! Published in 2021 at "Pharmaceutics"
DOI: 10.3390/pharmaceutics14010033
Abstract: Green chemistry implementation has led to promising results in waste reduction in the pharmaceutical industry. However, the early sustainable development of pharmaceutically active compounds and ingredients remains a considerable challenge. Herein, we wish to report… read more here.
Keywords: green design; computational analyses; synthesis computational; synthesis ... See more keywords
Proteomics Computational Analyses Suggest that the Antennavirus Glycoprotein Complex Includes a Class I Viral Fusion Protein (α-Penetrene) with an Internal Zinc-Binding Domain and a Stable Signal Peptide
Sign Up to like & getrecommendations! Published in 2019 at "Viruses"
DOI: 10.3390/v11080750
Abstract: A metatranscriptomic study of RNA viruses in cold-blooded vertebrates identified two related viruses from frogfish (Antennarius striatus) that represent a new genus Antennavirus in the family Arenaviridae (Order: Bunyavirales). Computational analyses were used to identify… read more here.
Keywords: class; computational analyses; fusion; zinc binding ... See more keywords