CAM-B3LYP/def2TZVP minima for neutral and metalated N-acetyl hexosamines
Fuente:
Zenodo
Saved in:
| Main Author: | Custodio, Kenee Kaiser |
|---|---|
| Format: | Recurso digital |
| Published: |
Zenodo
2026
|
| Online Access: | |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
Red‐ and Blue‐shifting Hydrogen Bonds of Cyclic Ketones of Varying Ring Sizes with HF and CHF3: Comparison of the Results of B3LYP, O3LYP, and M06‐2X Functionals
by: Bijan K. Paul
Published: (2025)
by: Bijan K. Paul
Published: (2025)
The Role of the Linearity on the Hydrogen Bond in the Formamide Dimer : a BLYP, B3LYP, and MP2 Study
by: José Zeferino Ramírez, Rubicelia Vargas y Jorge Garza
Published: (2008)
by: José Zeferino Ramírez, Rubicelia Vargas y Jorge Garza
Published: (2008)
The Role of the Linearity on the Hydrogen Bond in the Formamide Dimer: a BLYP, B3LYP, and MP2 Study
by: José Zeferino Ramírez
Published: (2008)
by: José Zeferino Ramírez
Published: (2008)
Comparison between PBE-D3, B3LYP, B3LYP-D3 and MP2 Methods for quantum mechanical calculations of polarizability and IR-NMR spectra in C24 isomers, including a novel isomer with D2d symmetry
by: Alhanzal, Futtaim, et al.
Published: (2025)
by: Alhanzal, Futtaim, et al.
Published: (2025)
Pharmacokinetics of N‐acetyl‐l‐cysteine in chickens
by: Albena Roydeva, et al.
Published: (2024)
by: Albena Roydeva, et al.
Published: (2024)
Fusion of Cyclohepta[def]fluorene Units: Toward Synthesis of High‐Spin Non‐Benzenoid Nanographenes
by: Fupeng Wu, et al.
Published: (2024)
by: Fupeng Wu, et al.
Published: (2024)
Mudskipper β-def2 exhibits potent broad-spectrum bactericidal activity via membrane-disrupting and DNA-targeting mechanisms.
by: Hu, Ya-Zhen, et al.
Published: (2025)
by: Hu, Ya-Zhen, et al.
Published: (2025)
Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine
by: Gerzon E. Delgado
Published: (2014)
by: Gerzon E. Delgado
Published: (2014)
E. coli acetyl-CoA carboxylase complex, AccB N-terminal modelling
by: Lohman, Jeremy
Published: (2025)
by: Lohman, Jeremy
Published: (2025)
Highly Efficient Cadmium‐Free Kesterite Solar Cell With the Lowest V OC,def Enabled by Na‐Ion‐Assisted Defect Passivation
by: Yonggang Zhao, et al.
Published: (2026)
by: Yonggang Zhao, et al.
Published: (2026)
LC–MS/MS determination of N‐acetyl‐l‐cysteine in chicken plasma
by: Albena Roydeva, et al.
Published: (2024)
by: Albena Roydeva, et al.
Published: (2024)
Amino acids and hexosamines in water and pore water samples from different oceanic areas sampled between 2013 and 2016
by: Gaye, Birgit, et al.
Published: (2022)
by: Gaye, Birgit, et al.
Published: (2022)
Estudio computacional B3LYP de la interacción del hidrógeno molecular [H2] con rccc R-Pyg[4]arenos [R = metil, flúor] funcionalizados con Li
by: Andrés S. Urbina
Published: (2011)
by: Andrés S. Urbina
Published: (2011)
Resolution of N‐acetyl‐DL‐methionine methyl ester by the lipase from Brucella thiophenivorans
by: Xiaojun Li, et al.
Published: (2024)
by: Xiaojun Li, et al.
Published: (2024)
The role of acetylation and deacetylation in cancer metabolism
by: Cuicui Wang, et al.
Published: (2025)
by: Cuicui Wang, et al.
Published: (2025)
Síntomas neuropsiquiátricos en encefalitis por anticuerpos contra el receptor N-metil-D-aspartato: a propósito de dos casos
by: N Custodio
Published: (2016)
by: N Custodio
Published: (2016)
Procedure to obtain the 3',5'-di-O-acetyl-5-formyl- 2'-deoxyuridine
by: Marquiza Sablón-Carrazana
Published: (2007)
by: Marquiza Sablón-Carrazana
Published: (2007)
Amino acids and hexosamines of sediment samples from different oceanic areas between 1987 and 2015 from shelf seas to the deep ocean
by: Gaye, Birgit, et al.
Published: (2022)
by: Gaye, Birgit, et al.
Published: (2022)
De-N-acetylated sialic acid is immunogenic and elicits antibodies that are protective against Neisseria meningitidis
by: Gregory R. Moe
Published: (2009)
by: Gregory R. Moe
Published: (2009)
N‐terminal acetylation orchestrates glycolate‐mediated ROS homeostasis to promote rice thermoresponsive growth
by: Xueting Li, et al.
Published: (2024)
by: Xueting Li, et al.
Published: (2024)
N ‐acetyl‐β‐hexosaminidase activity is important for chitooligosaccharide metabolism and biofilm formation in Burkholderia pseudomallei
by: Clare L. Moran, et al.
Published: (2024)
by: Clare L. Moran, et al.
Published: (2024)
Bulk plasmon-assisted ion neutralization at metal surfaces
by: Abdalaziz A. Almulhem
Published: (2002)
by: Abdalaziz A. Almulhem
Published: (2002)
Role of acute alcohol‐induced acetylation in tauopathy
by: Usman Sabir, et al.
Published: (2025)
by: Usman Sabir, et al.
Published: (2025)
The role of Nα‐terminal acetylation in protein conformation
by: Sam Calis, et al.
Published: (2024)
by: Sam Calis, et al.
Published: (2024)
Amino acids and hexosamines in suspended matter samples collected in different oceanic areas between 1999 and 2017 from shelf seas to the deep ocean
by: Gaye, Birgit, et al.
Published: (2022)
by: Gaye, Birgit, et al.
Published: (2022)
RETRACTION : Ameliorative Effect of N‐acetyl Cysteine on Alpha‐Cypermethrin‐Induced Pulmonary Toxicity in Male Rats
Published: (2026)
Published: (2026)
A Copper‐Incorporated meso‐(N’‐acetyl‐hydrizide)‐BODIPY as a “Off‐On” Fluorescent Probe for Histidine
by: Siyoung Cho, et al.
Published: (2024)
by: Siyoung Cho, et al.
Published: (2024)
Nicotinamide enhances Treg differentiation by promoting Foxp3 acetylation in immune thrombocytopenia
by: Ju Li, et al.
Published: (2024)
by: Ju Li, et al.
Published: (2024)
Amino acids and hexosamine in sediment trap samples from different oceanic areas collected between 1993 and 2017 from shelf seas to the deep ocean
by: Gaye, Birgit, et al.
Published: (2022)
by: Gaye, Birgit, et al.
Published: (2022)
Tailoring and characterization of chitosan with well-defined pattern of acetylation.
by: Li, Yupeng, et al.
Published: (2026)
by: Li, Yupeng, et al.
Published: (2026)
Histone acetylation regulated by histone deacetylases during spermatogenesis
by: Xiangying Ou, et al.
Published: (2024)
by: Xiangying Ou, et al.
Published: (2024)
Histone (de)acetylation in epigenetic regulation of Phytophthora pathobiology
by: Yufeng Guan, et al.
Published: (2024)
by: Yufeng Guan, et al.
Published: (2024)
Correlation and prediction of metal toxicity to aquatic biota
by: Kaiser, K. L. E
Published: (1980)
by: Kaiser, K. L. E
Published: (1980)
Hipersexualidad asociada a pramipexol, en el tratamiento de síntomas parkinsonianos: revisión de la literatura, a propósito de 3 casos
by: Nilton Custodio
Published: (2010)
by: Nilton Custodio
Published: (2010)
RETRACTION “Protective effects of N‐acetyl cysteine on lipid peroxide metabolism on isoproterenol‐induced myocardial infarcted rats,”
Published: (2024)
Published: (2024)
N‐terminal acetylation of superoxide dismutase 1 accelerates amyloid formation without general destabilization of the apo state
by: Kristine Steen Jensen
Published: (2025)
by: Kristine Steen Jensen
Published: (2025)
Demencia por deficiencia de vitamina B12: ¿Siempre hay respuesta terapéutica?
by: Nilton Custodio Capuñay
Published: (2011)
by: Nilton Custodio Capuñay
Published: (2011)
Low temperature formation of pyridine and (iso)quinoline via neutral neutral reactions
by: Yang, Zhenghai, et al.
Published: (2024)
by: Yang, Zhenghai, et al.
Published: (2024)
Recent advances of metal suboxide catalysts for carbon‐neutral energy applications
by: Shan Ding, et al.
Published: (2024)
by: Shan Ding, et al.
Published: (2024)
outputs of CAM5
by: xue, yuan
Published: (2025)
by: xue, yuan
Published: (2025)
Similar Items
-
Red‐ and Blue‐shifting Hydrogen Bonds of Cyclic Ketones of Varying Ring Sizes with HF and CHF3: Comparison of the Results of B3LYP, O3LYP, and M06‐2X Functionals
by: Bijan K. Paul
Published: (2025) -
The Role of the Linearity on the Hydrogen Bond in the Formamide Dimer : a BLYP, B3LYP, and MP2 Study
by: José Zeferino Ramírez, Rubicelia Vargas y Jorge Garza
Published: (2008) -
The Role of the Linearity on the Hydrogen Bond in the Formamide Dimer: a BLYP, B3LYP, and MP2 Study
by: José Zeferino Ramírez
Published: (2008) -
Comparison between PBE-D3, B3LYP, B3LYP-D3 and MP2 Methods for quantum mechanical calculations of polarizability and IR-NMR spectra in C24 isomers, including a novel isomer with D2d symmetry
by: Alhanzal, Futtaim, et al.
Published: (2025) -
Pharmacokinetics of N‐acetyl‐l‐cysteine in chickens
by: Albena Roydeva, et al.
Published: (2024)