| Id |
Subject |
Object |
Predicate |
Lexical cue |
| T66 |
19-187 |
Sentence |
denotes |
The interaction was driven by the positioning of the negative charge of the carboxylate group of Neu5Ac and one of the two cationic charges of CLQ (pKa 10.2) Fig. 2(c). |
| T67 |
188-263 |
Sentence |
denotes |
The energy of interaction of this complex was estimated to be -47 kJ.mol−1. |
| T68 |
264-489 |
Sentence |
denotes |
As coronaviruses preferentially interact with 9-O-acetyl-N-acetylneuraminic acid (9-O-SIA) [10], this study used a similar molecular modelling approach to assess whether CLQ could also interact with this specific sialic acid. |
| T69 |
490-597 |
Sentence |
denotes |
A good fit between CLQ and 9-O-SIA was obtained Fig. 2(d–f), with an energy of interaction of -45 kJ.mol−1. |
