Molecular dynamics simulations have emerged as a crucial tool for elucidating the intricate behaviour of ions in various solvents. Recent advances in ab initio techniques and hybrid quantum ...

Drug ZB MW and drug Z-ion MW calculations are needed for secondary labeling. Active moiety and bulk drug molecular weight assumptions: Drug Z-ion active moiety MW = 400 and Drug ZB salt MW = 550. 1.

They are literally channels for communication: Pore-forming proteins in living cells, termed ion channels, are embedded in the outer membrane of almost all cell types and play a crucial role in ...

Mapping how proteins change shape is vital but slow. Now, a new method combines AI (AlphaFold2) with experimental data to ...

Molecular dynamics simulations and ion mobility mass spectrometry reveal an anisotropic growth pathway for liraglutide oligomerization; ... PSA calculations reveal that the shape factor increases from ...

In molecular dynamics (MD), the accessible time scales are limited by the necessity to choose sufficiently small time steps so that the fastest vibrations of the system can still be modeled. Mass ...

Read the latest research in biochemistry -- protein structure and function, RNA and DNA, enzymes and biosynthesis and more biochemistry news.

Chemistry news. Read chemistry articles from research institutes around the world -- organic and inorganic chemistry -- including new techniques and inventions.

Benzene is soluble in water and has a melting point of 5.33 degrees Celsius.It also has a boiling point of 80.1 degrees Celsius.. Benzene is also highly flammable. This chemical is carcinogenic ...

The 3-D geometry of an ion-selective membrane (ISM) significantly impacts the practical performance of an ion-selective electrode (ISE), particularly regarding the ISEs conditioning time, potential ...