Results 111 to 120 of about 163,670 (314)

Global modelling of H₂ mixing ratios and isotopic compositions with the TM5 model

, 2011
The isotopic composition of molecular hydrogen (H2) contains independent information for constraining the global H2 budget. To explore this, we have implemented hydrogen sources and sinks, including their stable isotopic composition and isotope ...
Langenfelds, R.L., G. Pieterse, T. Röckmann, L. P. Steele, Pieterse, G., Afd Marine and Atmospheric Research, Marine and Atmospheric Research, Steele, L.P., Röckmann, T., Krummel, P.B., Sub Atmospheric physics and chemistry, M. C. Krol, P. B. Krummel, Krol, M.C., R. L. Langenfelds, A. M. Batenburg, Batenburg, A.M.   +16 more
core   +1 more source

A Combined Molecular Dynamics and Hydropathic INTeraction (HINT) Approach to Investigate Protein Flexibility: The PPARγ Case Study

Molecules
Molecular Dynamics (MD) is a computational technique widely used to evaluate a molecular system’s thermodynamic properties and conformational behavior over time.
Federica Agosta, Pietro Cozzini
doaj   +1 more source

The ubiquitin‐proteasome system and autophagy as guardians of the cellular proteome

FEBS Letters, EarlyView.
This Perspective covers the three principles governing the crosstalk between the ubiquitin‐proteasome system and autophagy in cellular proteostasis: (1) a shared ubiquitin code routing substrates via shuttle factors or autophagy receptors; (2) spatial compartmentalization into phase‐separated degradation hubs and organelle‐specific modules (exemplified
Ivan Dikic
wiley   +1 more source

Molecular Modelling

Journal of Pharmacy and Bioallied Sciences, 2009
<div>The use of computational chemistry in the development of novel pharmaceuticals is becoming an increasingly important</div><div>tool. In the past, drugs were simply screened for effectiveness.
Aarti Sharma, Himanshu Gupta
doaj  

Dapagliflozin: A new hope for the therapeutic treatment of type 2 diabetes mellitus

European Journal of Medicinal Chemistry Reports
Diabetes mellitus (Type 2) is a major world health problem spreading speedily throughout the world. It is a chronic illness that necessitates long-term therapy and care.
Naazneen Maksud, Sidhant Bera, Mohd Javed Naim, Ozair Alam   +3 more
doaj   +1 more source

An unexpected alternative viologen electron mediator site in tungsten‐containing formate dehydrogenase

FEBS Letters, EarlyView.
An unexpected alternative interaction site for ethyl viologen was identified in formate dehydrogenase 1 from Methylorubrum extorquens. Combined mutagenesis, kinetic analysis, and docking revealed that aromatic residues near an iron–sulfur cluster enable flavin mononucleotide‐independent electron transfer, offering a framework for engineering improved ...
Eleni G. Poloniataki, Yong Hwan Kim
wiley   +1 more source

3D modelling of branching in plants

, 2011
Shoot branching is a key determinant of overall aboveground plant form. During plant development, the number of branches formed strongly influences the amount of light absorbed by the plant, and thus the plant’s competitive strength in terms of light ...
Evers, J.B.
core  

A Molecular Modelling Study of 2,3-exo-disyndiotactic Polynorbornene [PDF]

, 2014
The present contribution reports a detailed molecular modelling study of the peculiar crystalline structure of the 2,3-exo-disyndiotactic polynorbornene (dsPNB) obtained by polymerization with a TiCl4 based catalysts.
MEILLE, STEFANO VALDO, FAMULARI, ANTONINO, BAGGIOLI, ALBERTO   +2 more
core  

Exploring RNA structure by integrative molecular modelling

, 2010
Udgivelsesdato: 2010-Jul-31RNA molecular modelling is adequate to rapidly tackle the structure of RNA molecules. With new structured RNAs constituting a central class of cellular regulators discovered every year, the need for swift and reliable modelling
Masquida, Benoît, Beckert, Bertrand, Jossinet, Fabrice   +2 more
core   +1 more source

Author Correction: Visualizing group II intron dynamics between the first and second steps of splicing

Nature Communications, 2022
Jacopo Manigrasso, Isabel Chillón, Vito Genna, Pietro Vidossich, Srinivas Somarowthu, Anna Marie Pyle, Marco De Vivo, Marco Marcia   +7 more
doaj   +1 more source