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PMC:7441777 / 16125-16407 JSONTXT

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LitCovid-PD-CLO

Id Subject Object Predicate Lexical cue
T106 138-139 http://purl.obolibrary.org/obo/CLO_0001020 denotes a
T107 171-175 http://purl.obolibrary.org/obo/CLO_0001146 denotes 1Å−2
T108 231-233 http://purl.obolibrary.org/obo/CLO_0007622 denotes MD

LitCovid-PD-CHEBI

Id Subject Object Predicate Lexical cue chebi_id
T243 197-202 Chemical denotes atoms http://purl.obolibrary.org/obo/CHEBI_33250
T244 231-233 Chemical denotes MD http://purl.obolibrary.org/obo/CHEBI_74699

LitCovid-sentences

Id Subject Object Predicate Lexical cue
T168 47-203 Sentence denotes Subsequently, all systems were gradually heated from 0 K to 300 K at the NVT ensemble with a force constant of 2.0 kcal mol−1Å−2 acting on all solute atoms.
T169 204-278 Sentence denotes Next, 1.0 ns equilibration MD phase was carried out without any restraint.