… Computational approaches based on structural knowledge have been used to identify
possible β-lactamase inhibitors from selected dry fruits. Herein, state-of-the-art bioinformatic …

… This thesis uses mainly computational data-driven approaches and secondly
experimental work to understand and answer questions of variation, taxonomy and functional …

… The bla TEM-1 sequences on pJD5 and pJRD20 were examined both computationally and
manually with DNAMAN software (v9 with default parameters, Lynnon Corp). Computational …

… to inhibit all tested metallo‐β‐lactamases and showed an in vitro synergistic bactericidal
effect with meropenem against metallo‐β‐lactamases‐producing bacteria. Dexrazoxane, …

… a mechanistic computational modeling framework (COMBAT- COmputational Model of …
-T solution and imaged at 700 nm and 800 nm using a Li-Cor Odyssey Sa scanning system. …

… Additionally, lead optimization driven by our computational … class of inhibitors that could
potentiate β-lactams against methicillin-… , and visualized using the Odyssey CLx Imaging System. …

… We carried out an extensive experimental and computational study aimed at quantitatively
… DHFR protein amount was quantified using an ODYSSEY infrared imaging system (LI-COR)…

… This reduces the computational resources required and speeds up how long the screening
campaign takes… The gels were imaged on an Odyssey CLx and quantified with Image Studio. …

… First, RASE identifies the lineage of the best-matching reference genome and estimates the
confidence of lineage assignment by comparing the two best-matching lineages to compute …

… for toxicity evaluation using computational toxicology is … computational toxicology modeling
continues to exist, and consensus predictions will still be the best strategy for computational …