PMID-sentid Pub_year Sent_text comp_official_name comp_offsetprotein_name organism prot_offset 34848758-8 2021 Molecular docking studies estimate a good binding propensity of DAPH+Cl- with non-structural proteins (nsp2 and nsp7-nsp-8) and the main protease (Mpro) of SARS-CoV-2. 4,5-dianilinophthalimide 64-68 ORF1a polyprotein;ORF1ab polyprotein Severe acute respiratory syndrome coronavirus 2 103-107 34848758-9 2021 The molecular dynamics simulation studies attribute the conformationally stable structures of the DAPH+Cl- bound Mpro and nsp2, nsp7-nsp8 complexes as evident from the considerable binding energy values, - 19.2 +- 0.3, - 25.7 +- 0.1, and - 24.5 +- 0.7 kcal/mol, respectively. 4,5-dianilinophthalimide 98-102 ORF1a polyprotein;ORF1ab polyprotein Severe acute respiratory syndrome coronavirus 2 122-126 34848758-9 2021 The molecular dynamics simulation studies attribute the conformationally stable structures of the DAPH+Cl- bound Mpro and nsp2, nsp7-nsp8 complexes as evident from the considerable binding energy values, - 19.2 +- 0.3, - 25.7 +- 0.1, and - 24.5 +- 0.7 kcal/mol, respectively. 4,5-dianilinophthalimide 98-102 ORF1a polyprotein;ORF1ab polyprotein Severe acute respiratory syndrome coronavirus 2 128-132 34848758-9 2021 The molecular dynamics simulation studies attribute the conformationally stable structures of the DAPH+Cl- bound Mpro and nsp2, nsp7-nsp8 complexes as evident from the considerable binding energy values, - 19.2 +- 0.3, - 25.7 +- 0.1, and - 24.5 +- 0.7 kcal/mol, respectively. 4,5-dianilinophthalimide 98-102 ORF1a polyprotein;ORF1ab polyprotein Severe acute respiratory syndrome coronavirus 2 133-137