3D-MoRSE descriptors

Virtual Computational Chemistry Laboratory

Software Groups of Indices Contributor

3D-MoRSE descriptors

Molecular descriptors calculated by summing atom weights viewed by a different angular scattering function.

RelNo	Symbol	Name	References
1	Mor01u	3D-MoRSE - signal 01 / unweighted	Schuur, J. & Gasteiger, J., Software Development in Chemistry - Vol. 10 (Gasteiger, J., ed.), Fachgruppe Chemie-lnformation-Computer (CIC), Frankfurt am Main, (1996). Schuur, J., Selzer, P. & Gasteiger, J., J.Chem.lnf.Comput.Sci., (1996), 36, 334-344. Gasteiger, J., Sadowski, J., Schuur, J., Selzer, P., Steinhauer, L. & Steinhauer, V., J .Chem Inf .Comput .Sci., (1996), 36,1030-1037. Schuur, J. & Gasteiger, J., Anal.Chem., (1997), 83, 2398-2405.
2	Mor02u	3D-MoRSE - signal 02 / unweighted
3	Mor03u	3D-MoRSE - signal 03 / unweighted
4	Mor04u	3D-MoRSE - signal 04 / unweighted
5	Mor05u	3D-MoRSE - signal 05 / unweighted
6	Mor06u	3D-MoRSE - signal 06 / unweighted
7	Mor07u	3D-MoRSE - signal 07 / unweighted
8	Mor08u	3D-MoRSE - signal 08 / unweighted
9	Mor09u	3D-MoRSE - signal 09 / unweighted
10	Mor10u	3D-MoRSE - signal 10 / unweighted
11	Mor11u	3D-MoRSE - signal 11 / unweighted
12	Mor12u	3D-MoRSE - signal 12 / unweighted
13	Mor13u	3D-MoRSE - signal 13 / unweighted
14	Mor14u	3D-MoRSE - signal 14 / unweighted
15	Mor15u	3D-MoRSE - signal 15 / unweighted
16	Mor16u	3D-MoRSE - signal 16 / unweighted
17	Mor17u	3D-MoRSE - signal 17 / unweighted
18	Mor18u	3D-MoRSE - signal 18 / unweighted
19	Mor19u	3D-MoRSE - signal 19 / unweighted
20	Mor20u	3D-MoRSE - signal 20 / unweighted
21	Mor21u	3D-MoRSE - signal 21 / unweighted
22	Mor22u	3D-MoRSE - signal 22 / unweighted
23	Mor23u	3D-MoRSE - signal 23 / unweighted
24	Mor24u	3D-MoRSE - signal 24 / unweighted
25	Mor25u	3D-MoRSE - signal 25 / unweighted
26	Mor26u	3D-MoRSE - signal 26 / unweighted
27	Mor27u	3D-MoRSE - signal 27 / unweighted
28	Mor28u	3D-MoRSE - signal 28 / unweighted
29	Mor29u	3D-MoRSE - signal 29 / unweighted
30	Mor30u	3D-MoRSE - signal 30 / unweighted
31	Mor31u	3D-MoRSE - signal 31 / unweighted
32	Mor32u	3D-MoRSE - signal 32 / unweighted
33	Mor01m	3D-MoRSE - signal 01 / weighted by atomic masses
34	Mor02m	3D-MoRSE - signal 02 / weighted by atomic masses
35	Mor03m	3D-MoRSE - signal 03 / weighted by atomic masses
36	Mor04m	3D-MoRSE - signal 04 / weighted by atomic masses
37	Mor05m	3D-MoRSE - signal 05 / weighted by atomic masses
38	Mor06m	3D-MoRSE - signal 06 / weighted by atomic masses
39	Mor07m	3D-MoRSE - signal 07 / weighted by atomic masses
40	Mor08m	3D-MoRSE - signal 08 / weighted by atomic masses
41	Mor09m	3D-MoRSE - signal 09 / weighted by atomic masses
42	Mor10m	3D-MoRSE - signal 10 / weighted by atomic masses
43	Mor11m	3D-MoRSE - signal 11 / weighted by atomic masses
44	Mor12m	3D-MoRSE - signal 12 / weighted by atomic masses
45	Mor13m	3D-MoRSE - signal 13 / weighted by atomic masses
46	Mor14m	3D-MoRSE - signal 14 / weighted by atomic masses
47	Mor15m	3D-MoRSE - signal 15 / weighted by atomic masses
48	Mor16m	3D-MoRSE - signal 16 / weighted by atomic masses
49	Mor17m	3D-MoRSE - signal 17 / weighted by atomic masses
50	Mor18m	3D-MoRSE - signal 18 / weighted by atomic masses
51	Mor19m	3D-MoRSE - signal 19 / weighted by atomic masses
52	Mor20m	3D-MoRSE - signal 20 / weighted by atomic masses
53	Mor21m	3D-MoRSE - signal 21 / weighted by atomic masses
54	Mor22m	3D-MoRSE - signal 22 / weighted by atomic masses
55	Mor23m	3D-MoRSE - signal 23 / weighted by atomic masses
56	Mor24m	3D-MoRSE - signal 24 / weighted by atomic masses
57	Mor25m	3D-MoRSE - signal 25 / weighted by atomic masses
58	Mor26m	3D-MoRSE - signal 26 / weighted by atomic masses
59	Mor27m	3D-MoRSE - signal 27 / weighted by atomic masses
60	Mor28m	3D-MoRSE - signal 28 / weighted by atomic masses
61	Mor29m	3D-MoRSE - signal 29 / weighted by atomic masses
62	Mor30m	3D-MoRSE - signal 30 / weighted by atomic masses
63	Mor31m	3D-MoRSE - signal 31 / weighted by atomic masses
64	Mor32m	3D-MoRSE - signal 32 / weighted by atomic masses
65	Mor01v	3D-MoRSE - signal 01 / weighted by atomic van der Waals volumes
66	Mor02v	3D-MoRSE - signal 02 / weighted by atomic van der Waals volumes
67	Mor03v	3D-MoRSE - signal 03 / weighted by atomic van der Waals volumes
68	Mor04v	3D-MoRSE - signal 04 / weighted by atomic van der Waals volumes
69	Mor05v	3D-MoRSE - signal 05 / weighted by atomic van der Waals volumes
70	Mor06v	3D-MoRSE - signal 06 / weighted by atomic van der Waals volumes
71	Mor07v	3D-MoRSE - signal 07 / weighted by atomic van der Waals volumes
72	Mor08v	3D-MoRSE - signal 08 / weighted by atomic van der Waals volumes
73	Mor09v	3D-MoRSE - signal 09 / weighted by atomic van der Waals volumes
74	Mor10v	3D-MoRSE - signal 10 / weighted by atomic van der Waals volumes
75	Mor11v	3D-MoRSE - signal 11 / weighted by atomic van der Waals volumes
76	Mor12v	3D-MoRSE - signal 12 / weighted by atomic van der Waals volumes
77	Mor13v	3D-MoRSE - signal 13 / weighted by atomic van der Waals volumes
78	Mor14v	3D-MoRSE - signal 14 / weighted by atomic van der Waals volumes
79	Mor15v	3D-MoRSE - signal 15 / weighted by atomic van der Waals volumes
80	Mor16v	3D-MoRSE - signal 16 / weighted by atomic van der Waals volumes
81	Mor17v	3D-MoRSE - signal 17 / weighted by atomic van der Waals volumes
82	Mor18v	3D-MoRSE - signal 18 / weighted by atomic van der Waals volumes
83	Mor19v	3D-MoRSE - signal 19 / weighted by atomic van der Waals volumes
84	Mor20v	3D-MoRSE - signal 20 / weighted by atomic van der Waals volumes
85	Mor21v	3D-MoRSE - signal 21 / weighted by atomic van der Waals volumes
86	Mor22v	3D-MoRSE - signal 22 / weighted by atomic van der Waals volumes
87	Mor23v	3D-MoRSE - signal 23 / weighted by atomic van der Waals volumes
88	Mor24v	3D-MoRSE - signal 24 / weighted by atomic van der Waals volumes
89	Mor25v	3D-MoRSE - signal 25 / weighted by atomic van der Waals volumes
90	Mor26v	3D-MoRSE - signal 26 / weighted by atomic van der Waals volumes
91	Mor27v	3D-MoRSE - signal 27 / weighted by atomic van der Waals volumes
92	Mor28v	3D-MoRSE - signal 28 / weighted by atomic van der Waals volumes
93	Mor29v	3D-MoRSE - signal 29 / weighted by atomic van der Waals volumes
94	Mor30v	3D-MoRSE - signal 30 / weighted by atomic van der Waals volumes
95	Mor31v	3D-MoRSE - signal 31 / weighted by atomic van der Waals volumes
96	Mor32v	3D-MoRSE - signal 32 / weighted by atomic van der Waals volumes
97	Mor01e	3D-MoRSE - signal 01 / weighted by atomic Sanderson electronegativities
98	Mor02e	3D-MoRSE - signal 02 / weighted by atomic Sanderson electronegativities
99	Mor03e	3D-MoRSE - signal 03 / weighted by atomic Sanderson electronegativities
100	Mor04e	3D-MoRSE - signal 04 / weighted by atomic Sanderson electronegativities
101	Mor05e	3D-MoRSE - signal 05 / weighted by atomic Sanderson electronegativities
102	Mor06e	3D-MoRSE - signal 06 / weighted by atomic Sanderson electronegativities
103	Mor07e	3D-MoRSE - signal 07 / weighted by atomic Sanderson electronegativities
104	Mor08e	3D-MoRSE - signal 08 / weighted by atomic Sanderson electronegativities
105	Mor09e	3D-MoRSE - signal 09 / weighted by atomic Sanderson electronegativities
106	Mor10e	3D-MoRSE - signal 10 / weighted by atomic Sanderson electronegativities
107	Mor11e	3D-MoRSE - signal 11 / weighted by atomic Sanderson electronegativities
108	Mor12e	3D-MoRSE - signal 12 / weighted by atomic Sanderson electronegativities
109	Mor13e	3D-MoRSE - signal 13 / weighted by atomic Sanderson electronegativities
110	Mor14e	3D-MoRSE - signal 14 / weighted by atomic Sanderson electronegativities
111	Mor15e	3D-MoRSE - signal 15 / weighted by atomic Sanderson electronegativities
112	Mor16e	3D-MoRSE - signal 16 / weighted by atomic Sanderson electronegativities
113	Mor17e	3D-MoRSE - signal 17 / weighted by atomic Sanderson electronegativities
114	Mor18e	3D-MoRSE - signal 18 / weighted by atomic Sanderson electronegativities
115	Mor19e	3D-MoRSE - signal 19 / weighted by atomic Sanderson electronegativities
116	Mor20e	3D-MoRSE - signal 20 / weighted by atomic Sanderson electronegativities
117	Mor21e	3D-MoRSE - signal 21 / weighted by atomic Sanderson electronegativities
118	Mor22e	3D-MoRSE - signal 22 / weighted by atomic Sanderson electronegativities
119	Mor23e	3D-MoRSE - signal 23 / weighted by atomic Sanderson electronegativities
120	Mor24e	3D-MoRSE - signal 24 / weighted by atomic Sanderson electronegativities
121	Mor25e	3D-MoRSE - signal 25 / weighted by atomic Sanderson electronegativities
122	Mor26e	3D-MoRSE - signal 26 / weighted by atomic Sanderson electronegativities
123	Mor27e	3D-MoRSE - signal 27 / weighted by atomic Sanderson electronegativities
124	Mor28e	3D-MoRSE - signal 28 / weighted by atomic Sanderson electronegativities
125	Mor29e	3D-MoRSE - signal 29 / weighted by atomic Sanderson electronegativities
126	Mor30e	3D-MoRSE - signal 30 / weighted by atomic Sanderson electronegativities
127	Mor31e	3D-MoRSE - signal 31 / weighted by atomic Sanderson electronegativities
128	Mor32e	3D-MoRSE - signal 32 / weighted by atomic Sanderson electronegativities
129	Mor01p	3D-MoRSE - signal 01 / weighted by atomic polarizabilities
130	Mor02p	3D-MoRSE - signal 02 / weighted by atomic polarizabilities
131	Mor03p	3D-MoRSE - signal 03 / weighted by atomic polarizabilities
132	Mor04p	3D-MoRSE - signal 04 / weighted by atomic polarizabilities
133	Mor05p	3D-MoRSE - signal 05 / weighted by atomic polarizabilities
134	Mor06p	3D-MoRSE - signal 06 / weighted by atomic polarizabilities
135	Mor07p	3D-MoRSE - signal 07 / weighted by atomic polarizabilities
136	Mor08p	3D-MoRSE - signal 08 / weighted by atomic polarizabilities
137	Mor09p	3D-MoRSE - signal 09 / weighted by atomic polarizabilities
138	Mor10p	3D-MoRSE - signal 10 / weighted by atomic polarizabilities
139	Mor11p	3D-MoRSE - signal 11 / weighted by atomic polarizabilities
140	Mor12p	3D-MoRSE - signal 12 / weighted by atomic polarizabilities
141	Mor13p	3D-MoRSE - signal 13 / weighted by atomic polarizabilities
142	Mor14p	3D-MoRSE - signal 14 / weighted by atomic polarizabilities
143	Mor15p	3D-MoRSE - signal 15 / weighted by atomic polarizabilities
144	Mor16p	3D-MoRSE - signal 16 / weighted by atomic polarizabilities
145	Mor17p	3D-MoRSE - signal 17 / weighted by atomic polarizabilities
146	Mor18p	3D-MoRSE - signal 18 / weighted by atomic polarizabilities
147	Mor19p	3D-MoRSE - signal 19 / weighted by atomic polarizabilities
148	Mor20p	3D-MoRSE - signal 20 / weighted by atomic polarizabilities
149	Mor21p	3D-MoRSE - signal 21 / weighted by atomic polarizabilities
150	Mor22p	3D-MoRSE - signal 22 / weighted by atomic polarizabilities
151	Mor23p	3D-MoRSE - signal 23 / weighted by atomic polarizabilities
152	Mor24p	3D-MoRSE - signal 24 / weighted by atomic polarizabilities
153	Mor25p	3D-MoRSE - signal 25 / weighted by atomic polarizabilities
154	Mor26p	3D-MoRSE - signal 26 / weighted by atomic polarizabilities
155	Mor27p	3D-MoRSE - signal 27 / weighted by atomic polarizabilities
156	Mor28p	3D-MoRSE - signal 28 / weighted by atomic polarizabilities
157	Mor29p	3D-MoRSE - signal 29 / weighted by atomic polarizabilities
158	Mor30p	3D-MoRSE - signal 30 / weighted by atomic polarizabilities
159	Mor31p	3D-MoRSE - signal 31 / weighted by atomic polarizabilities
160	Mor32p	3D-MoRSE - signal 32 / weighted by atomic polarizabilities

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