Journal: Frontiers in Pharmacology

Article Title: Targeting Leishmania infantum Mannosyl-oligosaccharide glucosidase with natural products: potential pH-dependent inhibition explored through computer-aided drug design

doi: 10.3389/fphar.2024.1403203

Figure Lengend Snippet: Molecular properties analysis and virtual screening. The chemical space of the generated dataset is represented visually by 3D-PCA (A) . binding affinities of NPs against Mannosyl-Oligosaccharide Glucosidase protein (B) from the dataset; and heatmap generated with Tanimoto scoring matrix of similar structures among compounds (C) .

Article Snippet: To generate a visual representation of the chemical space of the dataset for the auto-scaled properties of pharmaceutical interest, the principal component analysis (PCA), which reduces data dimensions by geometrically projecting them onto lower dimensions called principal components (PCs), calculated by the “PCA” KNIME node.

Techniques: Generated, Binding Assay

Journal: Ultrasonics Sonochemistry

Article Title: Multi-frequency power ultrasound as a novel approach improves intermediate-wave infrared drying process and quality attributes of pineapple slices

doi: 10.1016/j.ultsonch.2022.106083

Figure Lengend Snippet: Effects of ultrasound on the flavor of final products. A-C: Radar plots of different sample groups: US (A), US-OD (B), US-ET (C); D: Discrimination of flavor profile using the principal component analysis test (PCA); MFU, mono-frequency ultrasound; DFU, dual-frequency ultrasound; TFU, tri-frequency ultrasound; US (in distilled water); -OD (in sucrose), -ET (in ethanol).

Article Snippet: Graphs and the principal component analysis (PCA) were performed in OriginPro 9.8 (OriginLab Corporation, MA, USA).

Techniques: