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PMC:7544943 / 33328-34082 JSONTXT

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LitCovid-PD-FMA-UBERON

Id Subject Object Predicate Lexical cue fma_id
T46 73-80 Body_part denotes protein http://purl.org/sig/ont/fma/fma67257

LitCovid-PD-MONDO

Id Subject Object Predicate Lexical cue mondo_id
T69 743-751 Disease denotes SARS-CoV http://purl.obolibrary.org/obo/MONDO_0005091

LitCovid-PD-CLO

Id Subject Object Predicate Lexical cue
T159 211-213 http://purl.obolibrary.org/obo/CLO_0007622 denotes MD
T160 722-723 http://purl.obolibrary.org/obo/CLO_0001020 denotes a

LitCovid-PubTator

Id Subject Object Predicate Lexical cue tao:has_database_id
794 600-604 Gene denotes Mpro Gene:8673700
795 421-425 Gene denotes Mpro Gene:8673700
796 743-753 Species denotes SARS-CoV-2 Tax:2697049
797 403-416 Chemical denotes Spro-Piperine
798 565-573 Chemical denotes Piperine MESH:C008922
799 710-718 Chemical denotes Piperine MESH:C008922

LitCovid-sentences

Id Subject Object Predicate Lexical cue
T291 0-96 Sentence denotes The interaction energy is the measure of the interaction strength of the protein–ligand complex.
T292 97-239 Sentence denotes In order to validate the results of molecular docking studies, the analysis of the interaction free energies from MD simulation was performed.
T293 240-362 Sentence denotes The average interaction energy takes the contribution from the average short-range Lennard-Jones and van der Waals energy.
T294 363-519 Sentence denotes The average interaction energies of RBD Spro-Piperine and Mpro-Piperine are found to be − 41.401 ± 17.843 kJ/mol and −143.162 ± 23.043 kJ/mol, respectively.
T295 520-754 Sentence denotes These interaction energy values suggest that Piperine binds to the RBD Spro and Mpro with good affinity and hence supports the docking results, which in turn helps for the favourable use of Piperine as a drug candidate for SARS-CoV-2.