… C−X axis is distorted toward carbon, forming the C−X single bond. This leads to attractive
interactions between C… -bond acceptors, with a preference for linear C−X···B arrangements. For …

… Its phenolic group has clearly rotated around the Csp2-C.ar bond with respect to the
conformationally rigidified naphthol analogue (LY-357489) and could not be accommodated in the …

… To assess the acid lability of the albumin conjugate of 3, the conjugate was incubated at
pH 5.0 at 37 C and analyzed over a period of 3 h on a C-18 reverse-phase column. The initial …

… Similarly, Roche and Pfizer found that maximum promiscuity among their project compounds
was observed for a threshold c log P higher than 2.5–3 19, 21. These findings add to the …

The aim of the current study is to investigate whether homology models of G‐Protein‐Coupled
Receptors (GPCRs) that are based on bovine rhodopsin are reliable enough to be used …

… b,c, The in vivo efficacy of RO7075573 in a mouse model of infection induced by A. baumannii
ACC00535 (… c, Thigh infection was induced by bacterial intramuscular inoculation in …

We present a series of small molecule drug discovery case studies where computational
methods were prospectively employed to impact Roche research projects, with the aim of …

… They additionally share N‐linked glycosylation sites in the N‐terminal extracellular domain
and phosphorylation and palmitoylation sites at the C‐terminal intracellular domain. The …

… Roche compounds producing ≥50% inhibition at 10 μM (column C) were classified as a
hit in Roche assay targets. However, during the target selection process, where increased …

… acid a at position c, b ca . the pseudocount for amino acid a at position c, N c the total number
of counts, and B c the total number of pseudocounts at position c. The pseudocount b ca . …