An integrated web-based platform for molecular descriptor and fingerprint computation
51 | S51 | Sum of E-State of atom type: aaS |
52 | S52 | Sum of E-State of atom type: dssS |
53 | S53 | Sum of E-State of atom type: ddssS |
54 | S54 | Sum of E-State of atom type: sCl |
55 | S55 | Sum of E-State of atom type: sGeH3 |
56 | S56 | Sum of E-State of atom type: ssGeH2 |
57 | S57 | Sum of E-State of atom type: sssGeH |
58 | S58 | Sum of E-State of atom type: ssssGe |
59 | S59 | Sum of E-State of atom type: sAsH2 |
60 | S60 | Sum of E-State of atom type: ssAsH |
61 | S61 | Sum of E-State of atom type: sssAs |
62 | S62 | Sum of E-State of atom type: sssdAs |
63 | S63 | Sum of E-State of atom type: sssssAs |
64 | S64 | Sum of E-State of atom type: sSeH |
65 | S65 | Sum of E-State of atom type: dSe |
66 | S66 | Sum of E-State of atom type: ssSe |
67 | S67 | Sum of E-State of atom type: aaSe |
68 | S68 | Sum of E-State of atom type: dssSe |
69 | S69 | Sum of E-State of atom type: ddssSe |
70 | S70 | Sum of E-State of atom type: sBr |
71 | S71 | Sum of E-State of atom type: sSnH3 |
72 | S72 | Sum of E-State of atom type: ssSnH2 |
73 | S73 | Sum of E-State of atom type: sssSnH |
74 | S74 | Sum of E-State of atom type: ssssSn |
75 | S75 | Sum of E-State of atom type: sI |
76 | S76 | Sum of E-State of atom type: sPbH3 |
77 | S77 | Sum of E-State of atom type: ssPbH2 |
78 | S78 | Sum of E-State of atom type: sssPbH |
79 | S79 | Sum of E-State of atom type: ssssPb |
80 | Smax1-Smax79 | Maxmum of E-State value of specified atom type |
159 | Smin1-Smin79 | Minimum of E-State value of specified atom type |
238 | Shev | The sum of the EState indices over all non-hydrogen atoms |
239 | Scar | The sum of the EState indices over all C atoms |
240 | Shal | The sum of the EState indices over all Halogen atoms |
241 | Shet | The sum of the EState indices over all hetero atoms |
242 | Save | The sum of the EState indices over all non-hydrogen atoms divided by the number of non-hydrogen atoms |
243 | Smax | The maximal Estate value in all atoms |
244 | Smin | The minimal Estate value in all atoms |
245 | DS | The difference between Smax and Smin |
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