The MIT model predicts molecular binding affinity at newfound speed and accuracy, offering a powerful tool for commercial drug discovery.

As a recent leap in green chemistry, scientists have unveiled a new catalyst that enables high yields of sulfones using molecular oxygen -- at close to room temperature. By fine-tuning the ...

Hi, i finally got around to install influxdb+grafana, at least some data is vislible in influxdb 👍 Aside that gadgetbridge just fixed a bug (while i was writing another bug here ;)) for my xiaomi t ...

BESSY II: Molecular orbitals determine stability Date: February 7, 2024 Source: Helmholtz-Zentrum Berlin für Materialien und Energie Summary: Carboxylic acid dianions (fumarate, maleate and ...

Molecular geometry of the trans- and cis-isomers fumarate and maleate (above, left to right) together with their hydrogenated molecule, succinate−dianions (below) .

Peter and Miles may be scientists in Spider-Man 2, but we're not. When the molecular identification puzzles start to show up, we'll make them a breeze to solve.

b. Calculate bond order: If the compound obeys Huckel’s rule, the bond order for every bond present in the ring will be equal to (π electrons – 2) / (2 * total number of bonds in the ring). For ...

The molecular classification of endometrial cancer (EC) has proven to have prognostic value and is predictive of response to adjuvant chemotherapy. Here, we investigate its predictive value for ...