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1. Molecular Structural Control of the Amorphous-Crystalline Balance in Solids: Structure-Phase Correlation in DADQs with Enhanced/Switchable Fluorescence NSTL国家科技图书文献中心

Maurya, Ritesh Singh |  Radhakrishnan, T. P. -  《Chemistry》 - 2025,31(13) - n/a~n/a - 共12页

摘要: the A or C forms of molecular solids can guide the |  molecular solids has a direct bearing on their attributes |  analysis of the molecular features and interactions that |  reveal the significant impact of the molecular |  molecular orientations in the lattice, on the phase
关键词: Molecular solid |  Amorphous/crystalline forms |  Structure-activity relationships |  Quinodimethanes |  Phase Transitions |  Phase change materials

2. Exploring the performance and mechanisms of Mychonastes rotundus in fixing CO_2 based on multi-omics analysis NSTL国家科技图书文献中心

Lanhe Zhang |  Mingshuang Zhang... -  《Journal of cleaner production》 - 2025,491(Feb.1) - 144820.1~144820.10 - 共10页

摘要: various molecular forms of nutrients and light | Utilizing microalgae to immobilize carbon |  dioxide (CO_2) was regarded as one of the most |  environmentally friendly, safe and sustainable carbon capture | , utilization and storage technologies. Mychonastes rotundus
关键词: Mychonastes rotundus |  Physiological characteristics |  Carbon sequestration efficiency |  Metabolic pathways |  Key genes

3. Improving heat transfer prediction across catalytic SiC interface through a multiscale framework leveraging machine learning and data fusion techniques NSTL国家科技图书文献中心

Zhifan Ye |  Jin Zhao... -  《International Journal of Heat and Mass Transfer》 - 2025,236(Jan. Pt.1) - 126249.1~126249.19 - 共19页

摘要: their molecular forms at the air-solid interface, is | . The approach utilizes reactive molecular dynamics | Accurate aerothermal prediction under |  hypersonic flow conditions is crucial for any thermal |  protection materials design and engineering. The surface
关键词: Multiscale simulation |  Surface catalysis |  Aerodynamic heat |  Reactive molecular dynamics |  Machine learning |  Multiscale fusion |  Bayesian maximum entropy

4. Enhanced preservation of viability and species stratification in Lacticaseibacillus group using levan-fortified skim milk as a cryoprotectant during freeze-drying NSTL国家科技图书文献中心

Mustafa,Yavuz |  Merve,Erginer... -  《Food science and biotechnology》 - 2025,34(7) - 1605~1616 - 共12页

摘要:, supplemented with fructans such as inulin and diverse forms |  molecular masses (m/z) were preserved irrespective of the |  as potential species-specific molecular mass |  various forms as a cryoprotective agent alongside RSM | Abstract Ensuring the viability and accurate
关键词: Levan |  Lacticaseibacillus |  Freeze-drying |  Cryoprotectant |  Hydrogel |  MALDI-TOF MS

5. Large-Scale FMO-MP2 Calculations of the Spike Protein Droplet Model NSTL国家科技图书文献中心

Doi, Hideo |  Nakano, Tatsuya... -  《Journal of Computational Chemistry》 - 2025,46(4) - n/a~n/a - 共6页

摘要: droplet model by the fragment molecular orbital (FMO) at |  hundred structure samples from molecular dynamics (MD | ) simulations were used for both the closed and open forms of | The spike protein of SARS-CoV-2 is a |  challenging target for theoretical approaches. Here we
关键词: droplet model |  FMO |  fragment molecular orbital method |  MP2 |  second‐order Møller‐Plesset perturbation |  spike protein |  supercomputer Fugaku |  second-order M & oslash;ller-Plesset perturbation

6. Ferguson Plot Analysis of Chaperone ClpB from Moderate Halophile NSTL国家科技图书文献中心

Akuta, Teruo |  Tomioka, Yui... -  《The protein journal》 - 2025,44(1) - 79~87 - 共9页

摘要: determining the molecular weight of native proteins and | , derived from a moderate halophile that forms a native |  molecular weight of 1,500 kDa, approximately twice the | The Ferguson plot is a simple method for |  their complexes. In this study, we tested the validity
关键词: Ferguson plot |  ClpB |  Chaperone |  Assembly

7. Towards the recognition of oligogenic forms of type 2 diabetes NSTL国家科技图书文献中心

Le Collen L. |  Froguel P.... -  《Trends in Endocrinology and Metabolism》 - 2025,36(2) - 109~117 - 共9页

摘要: calling oligogenic forms of T2D, serving as a genetic |  link between these two forms. In this opinion article |  links between a signal and the molecular mechanisms |  forms of T2D has illuminated distinct causal | © 2024 Elsevier LtdThe demarcation between
关键词: monogenic |  oligogenic |  polygenic |  rare variant |  type 2 diabetes

8. The structural influence of the oncogenic driver mutation N642H in the STAT5B SH2 domain NSTL国家科技图书文献中心

Haas-Neill, Liam |  Meneksedag-Erol, Den...... -  《Protein science :》 - 2025,34(1) - e70022~e70022 - 共21页

摘要: forms of leukemia. This mutation is thought to promote | . However, the molecular mechanism leading to this | -atom molecular dynamics simulations of multiple |  oligomeric forms of both STAT5B and STAT5BN642H, including |  the SH2 domain. The molecular-level information
关键词: intrinsically disordered regions |  molecular dynamics simulations |  oncogenic mutation |  protein dynamics |  SH2 domains |  signal transducer and activator of transcription |  STAT proteins

9. The dynamics of nonlinear molecular waves in a (3+1)-dimensional nonlinear evolution equation in fluid mediums NSTL国家科技图书文献中心

Yao, Xuemin |  Wang, Lei -  《Nonlinear dynamics》 - 2025,113(10) - 11907~11920 - 共14页

摘要: nonlinear molecular waves related to solitons, breathers |  transformed molecular waves by adjusting specific parameters | , resulting in various types of molecular waves such as the | -shaped molecular waves. It is highlighted that |  molecular waves with transformed wave atoms exhibit
关键词: The (3+1)-dimensional nonlinear evolution equation |  Characteristic lines |  State transition |  Molecular waves |  Hirota bilinear method

10. Alkali Metal-adsorbed Graphyne and Graphdiyne (M@GY, M&GDY, M=Li or Na) as high-performance SP3T or 3P3T Near- and Mid-Far-infrared NLO molecular switches: A theoretical study NSTL国家科技图书文献中心

Jin, Wei |  Liu, Xue-Xia... -  《Surfaces and interfaces》 - 2025,60 - 共12页

摘要: devices and etc. NLO molecular switch can alternate |  between two or more chemical forms displaying contrasts | ) NLO molecular switches with high stability. From off |  form(s) to on forms in each case, the increases in | -responsive NLO molecular switching effects.
关键词: Graphdiyne |  Nonlinear optics |  Molecular switching effect |  Single-pole triple-throw |  Triple-pole triple-throw |  Mid-far-infrared transparency
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