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Differentiate DockGen-E and original DockGen test split
1 parent 18a0d81 commit 4f7fcbe

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2 files changed

+293
-171
lines changed

2 files changed

+293
-171
lines changed

data/splits/dockgen_test

+104-171
Original file line numberDiff line numberDiff line change
@@ -1,189 +1,122 @@
1-
2wr8_1_SAH_1
2-
3zqu_1_FNR_5
3-
3o7j_1_2AL_0
4-
2wwc_1_CHT_2
5-
5enp_1_5QF_0
6-
6fgc_1_ADP_1
7-
1uf7_1_CDV_0
8-
2r4e_1_13P_0
9-
5hw0_1_GLU_2
10-
4kgx_1_CTP_5
11-
4zaw_1_4LU_1
12-
4phr_1_UDP_0
13-
2v5e_1_GU4 YYJ_0
14-
4gk9_1_BMA MAN MAN MAN MAN_3
15-
6wyz_1_DGL_1
16-
6ep5_1_ADP_1
17-
4rpj_1_UDP_0
18-
5mh1_1_BMA_0
19-
3q14_1_PCR_3
20-
6rz2_1_5CD_2
21-
5hmr_1_FDZ_0
22-
2q6k_1_ADN_1
23-
6o6y_1_ACK_0
24-
5fxe_1_CIY_1
25-
4zay_1_4LS_6
26-
2wao_1_BGC BGC BGC BGC BGC_0
27-
3gf4_1_U5P_0
28-
4o95_1_245_0
29-
6xug_1_O1Q_0
30-
4mo2_2_FDA_0
31-
1pj4_1_FUM_1
32-
6b1b_1_TMO_15
33-
6o70_1_ACK_1
34-
3wvc_1_FEG_0
35-
4cdn_2_FAD_0
36-
5fxd_1_H7Y_1
37-
2gf3_2_FOA_1
1+
1hg0_1_SIN_1
2+
1o72_2_PC_0
3+
1pj2_1_FUM_0
4+
1qaw_1_TRP_7
5+
1rqp_1_SAM_0
6+
1sij_1_PCD_0
7+
1tke_1_SER_0
8+
1tkg_1_SSA_0
9+
1u8u_1_OCA_0
10+
1uf5_1_CDT_0
11+
1v2g_1_OCA_0
12+
2gag_1_FOA_0
3813
2gag_1_NAD_0
39-
4h2f_1_ADN_0
40-
2g7c_1_NAG GAL GLA_1
41-
6ur1_2_AT3_0
42-
3s5x_1_BMA MAN MAN MAN MAN_0
43-
4osy_1_GLY_3
44-
4qo5_1_NAG_2
45-
6pa6_2_ASN_0
46-
3uni_1_SAL_0
47-
2wab_1_BGC BGC BGC BGC BGC_0
48-
3sr6_1_MTE_1
49-
3ad7_1_NAD_0
14+
2gah_1_NAD_0
15+
2gf3_2_FOA_1
16+
2hk9_1_SKM_0
17+
2hs3_1_FGR_0
18+
2q37_1_3AL_0
19+
2q6k_1_ADN_1
20+
2r4e_1_13P_0
21+
2v7t_1_SAH_4
22+
2v7u_1_SAM_2
5023
2v7v_1_5FD_0
51-
3it6_1_ORN_1
52-
5k66_1_ASN GLU_0
53-
6a72_1_9UX_0
54-
2vdf_1_OCT_0
55-
4idk_1_1FE_0
5624
2v7w_1_5FD_0
57-
3k8m_1_GLC GLC AC1_0
58-
1qaw_1_TRP_7
59-
3zec_1_ANP_0
60-
5ida_1_BMA_0
61-
5f2t_1_PLM_0
25+
2vdf_1_OCT_0
26+
2vfu_1_MTL_0
27+
2wr8_1_SAH_1
28+
2wwc_1_CHT_2
29+
2xta_1_ACO_0
30+
2zcz_2_TRP_3
31+
2zd0_1_TRP_9
32+
2ze9_1_PD7_0
33+
3ad7_1_NAD_0
34+
3ad9_1_NAD_0
35+
3ada_1_NAD_0
6236
3eca_1_ASP_3
63-
2gag_1_FOA_0
64-
6jls_1_FMN_6
6537
3gf4_1_FAD_1
66-
4rhe_1_FMN_6
67-
6ea9_1_9BG_0
68-
6rms_1_AMP_1
69-
6xb3_3_9BG_1
70-
1uf8_1_ING_2
38+
3inr_1_GDU_0
39+
3jqm_1_GTP_5
40+
3o7j_1_2AL_0
7141
3s6a_1_ANP_0
72-
5k63_1_ASN GLY_0
73-
6ryz_1_SAM_2
74-
2zcz_2_TRP_3
75-
6v2a_1_ASN_3
76-
5a98_1_ATP_0
77-
5hhz_1_ZME_0
78-
3zzs_1_TRP_3
79-
5fiu_1_Y3J_3
80-
3gvl_1_SLB_2
42+
3se5_1_ANP_2
43+
3ub7_1_ACM_1
8144
3ub9_1_NHY_1
82-
4o0f_1_GLY_3
83-
5ent_1_MIY_0
84-
6nco_1_KQP_0
85-
3o02_2_JN3_0
86-
5dnc_1_ASN_2
87-
2x34_2_UQ8_0
88-
4rpm_1_HXC_0
89-
4qa8_1_PJZ_0
90-
5ae3_2_AWB_1
91-
5gqi_1_ATP_7
45+
3uni_1_SAL_0
46+
3wrb_1_GDE_0
47+
3zec_1_ANP_0
9248
3zjx_1_BOG_0
93-
3ju4_1_SLB_2
94-
3nvv_1_MTE_1
95-
6uqy_2_AT3_0
96-
4fyw_1_CTP_4
49+
3zzs_1_TRP_3
50+
4b4v_1_L34_0
51+
4cdn_2_FAD_0
52+
4cnl_1_CHT_1
9753
4fyv_1_DCP_2
54+
4h2f_1_ADN_0
55+
4idk_1_1FE_0
56+
4kgx_1_CTP_5
57+
4mig_1_G3F_2
58+
4o0d_1_GLY_3
59+
4o0f_1_GLY_3
60+
4o95_1_245_0
61+
4oal_2_245_0
62+
4osx_1_GLY_2
63+
4osy_1_GLY_3
64+
4pfx_1_UDP_0
65+
4phr_1_UDP_0
66+
4phs_1_UDP_0
67+
4qa8_1_PJZ_0
68+
4rhe_1_FMN_6
69+
4rpm_1_HXC_0
9870
4tvd_1_BGC_4
99-
3jqm_1_GTP_5
100-
2vfu_1_MTL_0
101-
2cdc_1_XYS_5
102-
1i8t_1_FAD_1
103-
1o28_1_UFP_2
104-
3wrb_1_GDE_0
71+
4tvd_1_GLC_0
72+
4u63_1_FAD_0
73+
4uoc_1_NCN_1
74+
4uuw_1_AMP_0
75+
4xdr_1_ADN_0
76+
4xfm_1_THE_0
77+
4ydx_1_TCE_0
78+
5b5s_1_BOG_0
79+
5dnc_1_ASN_2
80+
5f2t_1_PLM_0
81+
5f52_1_ASP_2
82+
5fiu_1_Y3J_3
83+
5fxd_1_H7Y_1
84+
5fxe_1_CIY_1
10585
5fxf_1_BEZ_0
106-
6yao_1_OJ2_0
107-
1hg0_1_SIN_1
86+
5gqi_1_ATP_7
87+
5hhz_1_ZME_0
88+
5hmr_1_FDZ_0
89+
5hqx_1_EDZ_0
90+
5hw0_1_GLU_2
91+
5ida_1_BMA_0
10892
5k3o_2_ASP_0
10993
5k45_2_GLU_1
110-
1v2g_1_OCA_0
11194
5k4h_2_GLU_3
112-
5gql_1_ATP_4
113-
6yap_1_OHZ_0
114-
3ada_1_NAD_0
115-
4uoc_1_NCN_1
116-
5hqx_1_EDZ_0
117-
3k8l_1_GLC GLC GLC GLC GLC_0
118-
3o01_2_DXC_0
119-
1sbz_1_FMN_3
120-
3ub7_1_ACM_1
121-
2o5m_1_MNR_0
122-
1pj2_1_FUM_0
123-
3ad9_1_NAD_0
124-
4phs_1_UDP_0
125-
4bc9_1_CNV FAD_0
126-
4pfx_1_UDP_0
127-
2v7t_1_SAH_4
128-
2ext_1_TRP_0
129-
3qrc_2_GU4 YYJ_0
130-
6fgc_1_D95_1
131-
6paa_1_ASP_2
132-
2hk9_1_SKM_0
133-
2q37_1_3AL_0
134-
4pya_1_2X3_0
135-
1o72_2_PC_0
136-
5enr_1_MBX_0
137-
2hs3_1_FGR_0
138-
6pa2_1_ASP_2
139-
4ydx_1_TCE_0
140-
1u8u_1_OCA_0
141-
3se5_1_ANP_2
142-
5d9g_1_GLU ASN LEU TYR PHE GLN_0
143-
4zaz_1_4LS_6
95+
5k62_1_ASN-VAL_0
96+
5k63_1_ASN-GLY_0
97+
5k66_1_ASN-GLU_0
98+
5mh1_1_BMA_0
14499
5u82_2_ZN0_0
145-
1za2_1_CTP_4
146-
1v97_1_MTE_1
147-
2xta_1_ACO_0
148-
6tvg_1_AP2_1
149-
4mig_1_G3F_2
150-
5k62_1_ASN VAL_0
151-
4xfm_1_THE_0
152-
3he3_5_UDP_0
153-
4n4l_1_HG1_0
154-
5f52_1_ASP_2
155-
4uuw_1_AMP_0
156-
4b4v_1_L34_0
100+
6a72_1_9UX_0
101+
6ea9_1_9BG_0
102+
6ep5_1_ADP_1
157103
6etf_1_AMP_0
158-
4cnl_1_CHT_1
159-
4zqx_1_ATP_2
160-
5ers_1_AMP_1
161-
4mos_1_GAF_1
162-
2him_1_ASN_3
163-
2xrh_1_NIO_1
164-
2zd0_1_TRP_9
165-
4oal_2_245_0
104+
6gbf_1_AMP_0
166105
6n19_2_K8V_0
167-
6a71_1_9UX_0
168-
1tkg_1_SSA_0
169-
1sij_1_PCD_0
170-
4xdr_1_ADN_0
171-
2gah_1_NAD_0
172-
1uf5_1_CDT_0
173-
2v7u_1_SAM_2
174-
5eno_1_5QG_0
175-
4u63_1_FAD_0
176-
5b5s_1_BOG_0
177-
2ze9_1_PD7_0
178-
6yaq_1_OHZ_0
179-
4o0d_1_GLY_3
180-
5enq_1_5QE_0
181-
4osx_1_GLY_2
106+
6nco_1_KQP_0
107+
6o6y_1_ACK_0
108+
6o70_1_ACK_1
109+
6pa2_1_ASP_2
110+
6pa6_2_ASN_0
111+
6paa_1_ASP_2
182112
6qkr_1_FAD_0
183-
3inr_1_GDU_0
184-
6npp_1_KWG_0
185-
4zav_1_4LS_8
186-
6gbf_1_AMP_0
187-
4tvd_1_GLC_0
188-
1tke_1_SER_0
189-
1rqp_1_SAM_0
113+
6ryz_1_SAM_2
114+
6uqy_2_AT3_0
115+
6ur1_2_AT3_0
116+
6v2a_1_ASN_3
117+
6wyz_1_DGL_1
118+
6xb3_3_9BG_1
119+
6xug_1_O1Q_0
120+
6yao_1_OJ2_0
121+
6yap_1_OHZ_0
122+
6yaq_1_OHZ_0

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