Degree-Based Topological Indices and QSPR Analysis of Antituberculosis Drugs

Table 19

Comparison of actual values computed values for molar volume from regression models.

Name of drug	Molar volume of drug	Molar volume computed from regression model for ABC index	Molar volume computed from regression model for R(G) index	Molar volume computed from regression model for S(G) index	Molar volume computed from regression model for GA(G) index	Molar volume computed from regression model for M1(G) index	Molar volume computed from regression model for M2(G) index	Molar volume computed from regression model H(G) index	Molar volume computed from regression of HM(G); Index	Molar volume computed from regression model for ZG3(G)	Molar volume computed from regression model of F(G) index	Molar volume computed from regression model of SSD(G)
Amikacin	363.9	392.65	400.98	393.92	407.20	365.72	391.20	397.31	389.95	381.74	383.54	401.74
Bedaquiline	420.1	369.74	374.27	376.97	396.60	363.89	319.64	380.32	360.40	303.01	356.98	358.65
Clofazimine	366.1	351.98	354.23	357.78	224.35	356.56	346.84	359.48	340.70	303.01	336.25	340.25
Delamanid	368	394.10	388.92	392.08	409.36	389.54	372.60	390.51	375.69	416.73	379.65	394.44
Ethambutol	207	143.17	171.35	157.06	186.07	125.66	123.56	172.35	120.26	154.28	117.94	145.71
Ethionamide	142	109.55	107.59	107.65	151.93	107.34	114.97	106.65	114.14	136.79	112.75	115.29
Imipenem-cilastatin	183.9	210.15	207.54	206.68	242.11	213.62	223.75	204.74	221.48	206.77	220.29	219.21
Isoniazid	110.2	110.44	107.16	107.44	151.76	107.34	116.41	105.88	114.14	119.29	133.48	116.54
Levofloxacin	244	271.93	261.39	267.53	302.11	283.26	303.90	261.38	290.77	241.77	287.66	273.70
Linezolid	259	255.19	252.35	254.25	285.65	253.94	255.24	253.00	252.05	416.73	250.09	254.69
Moxifloxacin	285	314.43	305.12	313.26	207.11	330.90	345.40	307.51	338.32	259.26	333.01	310.48
p-Aminosalicylic acid	102.7	111.84	104.79	105.20	150.30	111.00	120.70	101.21	120.26	154.28	120.53	122.89
Pyrazinamide	87.7	91.66	87.56	88.86	102.54	116.50	99.23	86.94	96.48	101.79	94.61	96.28
Rifampin	611.7	577.92	583.43	575.64	571.09	581.96	572.97	577.42	575.75	530.46	586.30	592.51