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1 | 1 | """Constants for the PEtab edit GUI.""" |
2 | 2 |
|
3 | 3 | import numpy as np |
4 | | -import petab.v1.C as C |
| 4 | +import petab.v1.C as PETAB_C |
5 | 5 |
|
6 | 6 | #: Application name |
7 | 7 | APP_NAME = "PEtab-GUI" |
|
12 | 12 |
|
13 | 13 | COLUMNS = { |
14 | 14 | "measurement": { |
15 | | - C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
16 | | - C.PREEQUILIBRATION_CONDITION_ID: { |
| 15 | + PETAB_C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
| 16 | + PETAB_C.PREEQUILIBRATION_CONDITION_ID: { |
17 | 17 | "type": np.object_, |
18 | 18 | "optional": True, |
19 | 19 | }, |
20 | | - C.SIMULATION_CONDITION_ID: {"type": np.object_, "optional": False}, |
21 | | - C.TIME: {"type": np.float64, "optional": False}, |
22 | | - C.MEASUREMENT: {"type": np.float64, "optional": False}, |
23 | | - C.OBSERVABLE_PARAMETERS: {"type": np.object_, "optional": True}, |
24 | | - C.NOISE_PARAMETERS: {"type": np.object_, "optional": True}, |
25 | | - C.DATASET_ID: {"type": np.object_, "optional": True}, |
26 | | - C.REPLICATE_ID: {"type": np.object_, "optional": True}, |
| 20 | + PETAB_C.SIMULATION_CONDITION_ID: { |
| 21 | + "type": np.object_, |
| 22 | + "optional": False, |
| 23 | + }, |
| 24 | + PETAB_C.TIME: {"type": np.float64, "optional": False}, |
| 25 | + PETAB_C.MEASUREMENT: {"type": np.float64, "optional": False}, |
| 26 | + PETAB_C.OBSERVABLE_PARAMETERS: {"type": np.object_, "optional": True}, |
| 27 | + PETAB_C.NOISE_PARAMETERS: {"type": np.object_, "optional": True}, |
| 28 | + PETAB_C.DATASET_ID: {"type": np.object_, "optional": True}, |
| 29 | + PETAB_C.REPLICATE_ID: {"type": np.object_, "optional": True}, |
27 | 30 | }, |
28 | 31 | "simulation": { |
29 | | - C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
30 | | - C.PREEQUILIBRATION_CONDITION_ID: { |
| 32 | + PETAB_C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
| 33 | + PETAB_C.PREEQUILIBRATION_CONDITION_ID: { |
31 | 34 | "type": np.object_, |
32 | 35 | "optional": True, |
33 | 36 | }, |
34 | | - C.SIMULATION_CONDITION_ID: {"type": np.object_, "optional": False}, |
35 | | - C.TIME: {"type": np.float64, "optional": False}, |
36 | | - C.SIMULATION: {"type": np.float64, "optional": False}, |
37 | | - C.OBSERVABLE_PARAMETERS: {"type": np.object_, "optional": True}, |
38 | | - C.NOISE_PARAMETERS: {"type": np.object_, "optional": True}, |
39 | | - C.DATASET_ID: {"type": np.object_, "optional": True}, |
40 | | - C.REPLICATE_ID: {"type": np.object_, "optional": True}, |
| 37 | + PETAB_C.SIMULATION_CONDITION_ID: { |
| 38 | + "type": np.object_, |
| 39 | + "optional": False, |
| 40 | + }, |
| 41 | + PETAB_C.TIME: {"type": np.float64, "optional": False}, |
| 42 | + PETAB_C.SIMULATION: {"type": np.float64, "optional": False}, |
| 43 | + PETAB_C.OBSERVABLE_PARAMETERS: {"type": np.object_, "optional": True}, |
| 44 | + PETAB_C.NOISE_PARAMETERS: {"type": np.object_, "optional": True}, |
| 45 | + PETAB_C.DATASET_ID: {"type": np.object_, "optional": True}, |
| 46 | + PETAB_C.REPLICATE_ID: {"type": np.object_, "optional": True}, |
41 | 47 | }, |
42 | 48 | "observable": { |
43 | | - C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
44 | | - C.OBSERVABLE_NAME: {"type": np.object_, "optional": True}, |
45 | | - C.OBSERVABLE_FORMULA: {"type": np.object_, "optional": False}, |
46 | | - C.OBSERVABLE_TRANSFORMATION: {"type": np.object_, "optional": True}, |
47 | | - C.NOISE_FORMULA: {"type": np.object_, "optional": False}, |
48 | | - C.NOISE_DISTRIBUTION: {"type": np.object_, "optional": True}, |
| 49 | + PETAB_C.OBSERVABLE_ID: {"type": np.object_, "optional": False}, |
| 50 | + PETAB_C.OBSERVABLE_NAME: {"type": np.object_, "optional": True}, |
| 51 | + PETAB_C.OBSERVABLE_FORMULA: {"type": np.object_, "optional": False}, |
| 52 | + PETAB_C.OBSERVABLE_TRANSFORMATION: { |
| 53 | + "type": np.object_, |
| 54 | + "optional": True, |
| 55 | + }, |
| 56 | + PETAB_C.NOISE_FORMULA: {"type": np.object_, "optional": False}, |
| 57 | + PETAB_C.NOISE_DISTRIBUTION: {"type": np.object_, "optional": True}, |
49 | 58 | }, |
50 | 59 | "parameter": { |
51 | | - C.PARAMETER_ID: {"type": np.object_, "optional": False}, |
52 | | - C.PARAMETER_NAME: {"type": np.object_, "optional": True}, |
53 | | - C.PARAMETER_SCALE: {"type": np.object_, "optional": False}, |
54 | | - C.LOWER_BOUND: {"type": np.float64, "optional": False}, |
55 | | - C.UPPER_BOUND: {"type": np.float64, "optional": False}, |
56 | | - C.NOMINAL_VALUE: {"type": np.float64, "optional": False}, |
57 | | - C.ESTIMATE: {"type": np.object_, "optional": False}, |
58 | | - C.INITIALIZATION_PRIOR_TYPE: {"type": np.object_, "optional": True}, |
59 | | - C.INITIALIZATION_PRIOR_PARAMETERS: { |
| 60 | + PETAB_C.PARAMETER_ID: {"type": np.object_, "optional": False}, |
| 61 | + PETAB_C.PARAMETER_NAME: {"type": np.object_, "optional": True}, |
| 62 | + PETAB_C.PARAMETER_SCALE: {"type": np.object_, "optional": False}, |
| 63 | + PETAB_C.LOWER_BOUND: {"type": np.float64, "optional": False}, |
| 64 | + PETAB_C.UPPER_BOUND: {"type": np.float64, "optional": False}, |
| 65 | + PETAB_C.NOMINAL_VALUE: {"type": np.float64, "optional": False}, |
| 66 | + PETAB_C.ESTIMATE: {"type": np.object_, "optional": False}, |
| 67 | + PETAB_C.INITIALIZATION_PRIOR_TYPE: { |
| 68 | + "type": np.object_, |
| 69 | + "optional": True, |
| 70 | + }, |
| 71 | + PETAB_C.INITIALIZATION_PRIOR_PARAMETERS: { |
| 72 | + "type": np.object_, |
| 73 | + "optional": True, |
| 74 | + }, |
| 75 | + PETAB_C.OBJECTIVE_PRIOR_TYPE: {"type": np.object_, "optional": True}, |
| 76 | + PETAB_C.OBJECTIVE_PRIOR_PARAMETERS: { |
60 | 77 | "type": np.object_, |
61 | 78 | "optional": True, |
62 | 79 | }, |
63 | | - C.OBJECTIVE_PRIOR_TYPE: {"type": np.object_, "optional": True}, |
64 | | - C.OBJECTIVE_PRIOR_PARAMETERS: {"type": np.object_, "optional": True}, |
65 | 80 | }, |
66 | 81 | "condition": { |
67 | | - C.CONDITION_ID: {"type": np.object_, "optional": False}, |
68 | | - C.CONDITION_NAME: {"type": np.object_, "optional": False}, |
| 82 | + PETAB_C.CONDITION_ID: {"type": np.object_, "optional": False}, |
| 83 | + PETAB_C.CONDITION_NAME: {"type": np.object_, "optional": False}, |
69 | 84 | }, |
70 | 85 | "visualization": { |
71 | | - C.PLOT_ID: {"type": np.object_, "optional": False}, |
72 | | - C.PLOT_NAME: {"type": np.object_, "optional": True}, |
73 | | - C.PLOT_TYPE_SIMULATION: { |
| 86 | + PETAB_C.PLOT_ID: {"type": np.object_, "optional": False}, |
| 87 | + PETAB_C.PLOT_NAME: {"type": np.object_, "optional": True}, |
| 88 | + PETAB_C.PLOT_TYPE_SIMULATION: { |
74 | 89 | "type": np.object_, |
75 | 90 | "optional": True, |
76 | 91 | }, |
77 | | - C.PLOT_TYPE_DATA: {"type": np.object_, "optional": True}, |
78 | | - C.DATASET_ID: {"type": np.object_, "optional": True}, |
79 | | - C.X_VALUES: {"type": np.object_, "optional": True}, |
80 | | - C.X_OFFSET: {"type": np.float64, "optional": True}, |
81 | | - C.X_LABEL: {"type": np.object_, "optional": True}, |
82 | | - C.X_SCALE: {"type": np.object_, "optional": True}, |
83 | | - C.Y_VALUES: {"type": np.object_, "optional": True}, |
84 | | - C.Y_OFFSET: {"type": np.float64, "optional": True}, |
85 | | - C.Y_LABEL: {"type": np.object_, "optional": True}, |
86 | | - C.Y_SCALE: {"type": np.object_, "optional": True}, |
87 | | - C.LEGEND_ENTRY: {"type": np.object_, "optional": True}, |
| 92 | + PETAB_C.PLOT_TYPE_DATA: {"type": np.object_, "optional": True}, |
| 93 | + PETAB_C.DATASET_ID: {"type": np.object_, "optional": True}, |
| 94 | + PETAB_C.X_VALUES: {"type": np.object_, "optional": True}, |
| 95 | + PETAB_C.X_OFFSET: {"type": np.float64, "optional": True}, |
| 96 | + PETAB_C.X_LABEL: {"type": np.object_, "optional": True}, |
| 97 | + PETAB_C.X_SCALE: {"type": np.object_, "optional": True}, |
| 98 | + PETAB_C.Y_VALUES: {"type": np.object_, "optional": True}, |
| 99 | + PETAB_C.Y_OFFSET: {"type": np.float64, "optional": True}, |
| 100 | + PETAB_C.Y_LABEL: {"type": np.object_, "optional": True}, |
| 101 | + PETAB_C.Y_SCALE: {"type": np.object_, "optional": True}, |
| 102 | + PETAB_C.LEGEND_ENTRY: {"type": np.object_, "optional": True}, |
88 | 103 | }, |
89 | 104 | } |
90 | 105 |
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|
133 | 148 |
|
134 | 149 | # Default Configurations of Default Values |
135 | 150 | ALLOWED_STRATEGIES_OBS = { |
136 | | - C.OBSERVABLE_ID: STRATEGIES_DEFAULT, |
137 | | - C.OBSERVABLE_NAME: STRATEGIES_DEFAULT, |
138 | | - C.OBSERVABLE_FORMULA: STRATEGIES_DEFAULT, |
139 | | - C.OBSERVABLE_TRANSFORMATION: [USE_DEFAULT, NO_DEFAULT, MODE], |
140 | | - C.NOISE_FORMULA: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
141 | | - C.NOISE_DISTRIBUTION: [USE_DEFAULT, NO_DEFAULT, MODE], |
| 151 | + PETAB_C.OBSERVABLE_ID: STRATEGIES_DEFAULT, |
| 152 | + PETAB_C.OBSERVABLE_NAME: STRATEGIES_DEFAULT, |
| 153 | + PETAB_C.OBSERVABLE_FORMULA: STRATEGIES_DEFAULT, |
| 154 | + PETAB_C.OBSERVABLE_TRANSFORMATION: [USE_DEFAULT, NO_DEFAULT, MODE], |
| 155 | + PETAB_C.NOISE_FORMULA: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
| 156 | + PETAB_C.NOISE_DISTRIBUTION: [USE_DEFAULT, NO_DEFAULT, MODE], |
142 | 157 | } |
143 | 158 | ALLOWED_STRATEGIES_PAR = { |
144 | | - C.PARAMETER_ID: STRATEGIES_DEFAULT, |
145 | | - C.PARAMETER_NAME: STRATEGIES_DEFAULT, |
146 | | - C.PARAMETER_SCALE: [USE_DEFAULT, NO_DEFAULT, MODE], |
147 | | - C.LOWER_BOUND: [MIN_COLUMN, MAX_COLUMN, USE_DEFAULT, NO_DEFAULT, MODE], |
148 | | - C.UPPER_BOUND: [MAX_COLUMN, MAX_COLUMN, USE_DEFAULT, NO_DEFAULT, MODE], |
149 | | - C.NOMINAL_VALUE: [USE_DEFAULT, NO_DEFAULT, SBML_LOOK], |
150 | | - C.ESTIMATE: [USE_DEFAULT, NO_DEFAULT, MODE], |
| 159 | + PETAB_C.PARAMETER_ID: STRATEGIES_DEFAULT, |
| 160 | + PETAB_C.PARAMETER_NAME: STRATEGIES_DEFAULT, |
| 161 | + PETAB_C.PARAMETER_SCALE: [USE_DEFAULT, NO_DEFAULT, MODE], |
| 162 | + PETAB_C.LOWER_BOUND: [ |
| 163 | + MIN_COLUMN, |
| 164 | + MAX_COLUMN, |
| 165 | + USE_DEFAULT, |
| 166 | + NO_DEFAULT, |
| 167 | + MODE, |
| 168 | + ], |
| 169 | + PETAB_C.UPPER_BOUND: [ |
| 170 | + MAX_COLUMN, |
| 171 | + MAX_COLUMN, |
| 172 | + USE_DEFAULT, |
| 173 | + NO_DEFAULT, |
| 174 | + MODE, |
| 175 | + ], |
| 176 | + PETAB_C.NOMINAL_VALUE: [USE_DEFAULT, NO_DEFAULT, SBML_LOOK], |
| 177 | + PETAB_C.ESTIMATE: [USE_DEFAULT, NO_DEFAULT, MODE], |
151 | 178 | } |
152 | 179 | ALLOWED_STRATEGIES_COND = { |
153 | | - C.CONDITION_ID: STRATEGIES_DEFAULT, |
154 | | - C.CONDITION_NAME: STRATEGIES_DEFAULT, |
| 180 | + PETAB_C.CONDITION_ID: STRATEGIES_DEFAULT, |
| 181 | + PETAB_C.CONDITION_NAME: STRATEGIES_DEFAULT, |
155 | 182 | } |
156 | 183 | ALLOWED_STRATEGIES_MEAS = { |
157 | | - C.OBSERVABLE_ID: STRATEGIES_DEFAULT, |
158 | | - C.PREEQUILIBRATION_CONDITION_ID: STRATEGIES_DEFAULT_EXT, |
159 | | - C.SIMULATION_CONDITION_ID: STRATEGIES_DEFAULT_EXT, |
160 | | - C.TIME: [NO_DEFAULT, USE_DEFAULT, MODE], |
161 | | - C.MEASUREMENT: [NO_DEFAULT, USE_DEFAULT, MODE], |
162 | | - C.OBSERVABLE_PARAMETERS: STRATEGIES_DEFAULT_EXT, |
163 | | - C.NOISE_PARAMETERS: STRATEGIES_DEFAULT_EXT, |
164 | | - C.DATASET_ID: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
165 | | - C.REPLICATE_ID: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
| 184 | + PETAB_C.OBSERVABLE_ID: STRATEGIES_DEFAULT, |
| 185 | + PETAB_C.PREEQUILIBRATION_CONDITION_ID: STRATEGIES_DEFAULT_EXT, |
| 186 | + PETAB_C.SIMULATION_CONDITION_ID: STRATEGIES_DEFAULT_EXT, |
| 187 | + PETAB_C.TIME: [NO_DEFAULT, USE_DEFAULT, MODE], |
| 188 | + PETAB_C.MEASUREMENT: [NO_DEFAULT, USE_DEFAULT, MODE], |
| 189 | + PETAB_C.OBSERVABLE_PARAMETERS: STRATEGIES_DEFAULT_EXT, |
| 190 | + PETAB_C.NOISE_PARAMETERS: STRATEGIES_DEFAULT_EXT, |
| 191 | + PETAB_C.DATASET_ID: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
| 192 | + PETAB_C.REPLICATE_ID: [COPY_FROM, USE_DEFAULT, NO_DEFAULT, MODE], |
166 | 193 | } |
167 | 194 | ALLOWED_STRATEGIES = { |
168 | 195 | "observable": ALLOWED_STRATEGIES_OBS, |
|
171 | 198 | "measurement": ALLOWED_STRATEGIES_MEAS, |
172 | 199 | } |
173 | 200 | DEFAULT_OBS_CONFIG = { |
174 | | - C.OBSERVABLE_ID: { |
| 201 | + PETAB_C.OBSERVABLE_ID: { |
175 | 202 | "strategy": COPY_FROM, |
176 | | - SOURCE_COLUMN: C.OBSERVABLE_FORMULA, |
| 203 | + SOURCE_COLUMN: PETAB_C.OBSERVABLE_FORMULA, |
177 | 204 | DEFAULT_VALUE: "new_observable", |
178 | 205 | }, |
179 | | - C.OBSERVABLE_NAME: {"strategy": COPY_FROM, SOURCE_COLUMN: C.OBSERVABLE_ID}, |
180 | | - C.NOISE_FORMULA: {"strategy": USE_DEFAULT, DEFAULT_VALUE: 1}, |
181 | | - C.OBSERVABLE_TRANSFORMATION: { |
| 206 | + PETAB_C.OBSERVABLE_NAME: { |
| 207 | + "strategy": COPY_FROM, |
| 208 | + SOURCE_COLUMN: PETAB_C.OBSERVABLE_ID, |
| 209 | + }, |
| 210 | + PETAB_C.NOISE_FORMULA: {"strategy": USE_DEFAULT, DEFAULT_VALUE: 1}, |
| 211 | + PETAB_C.OBSERVABLE_TRANSFORMATION: { |
182 | 212 | "strategy": USE_DEFAULT, |
183 | | - DEFAULT_VALUE: C.LIN, |
| 213 | + DEFAULT_VALUE: PETAB_C.LIN, |
| 214 | + }, |
| 215 | + PETAB_C.NOISE_DISTRIBUTION: { |
| 216 | + "strategy": USE_DEFAULT, |
| 217 | + DEFAULT_VALUE: PETAB_C.NORMAL, |
184 | 218 | }, |
185 | | - C.NOISE_DISTRIBUTION: {"strategy": USE_DEFAULT, DEFAULT_VALUE: C.NORMAL}, |
186 | 219 | } |
187 | 220 | DEFAULT_PAR_CONFIG = { |
188 | | - C.PARAMETER_NAME: { |
| 221 | + PETAB_C.PARAMETER_NAME: { |
189 | 222 | "strategy": COPY_FROM, |
190 | | - SOURCE_COLUMN: C.PARAMETER_ID, |
| 223 | + SOURCE_COLUMN: PETAB_C.PARAMETER_ID, |
191 | 224 | DEFAULT_VALUE: "new_parameter", |
192 | 225 | }, |
193 | | - C.PARAMETER_SCALE: {"strategy": USE_DEFAULT, DEFAULT_VALUE: C.LOG10}, |
194 | | - C.LOWER_BOUND: {"strategy": MIN_COLUMN}, |
195 | | - C.UPPER_BOUND: {"strategy": MAX_COLUMN}, |
196 | | - C.ESTIMATE: {"strategy": USE_DEFAULT, DEFAULT_VALUE: 1}, |
197 | | - C.NOMINAL_VALUE: {"strategy": SBML_LOOK}, |
| 226 | + PETAB_C.PARAMETER_SCALE: { |
| 227 | + "strategy": USE_DEFAULT, |
| 228 | + DEFAULT_VALUE: PETAB_C.LOG10, |
| 229 | + }, |
| 230 | + PETAB_C.LOWER_BOUND: {"strategy": MIN_COLUMN}, |
| 231 | + PETAB_C.UPPER_BOUND: {"strategy": MAX_COLUMN}, |
| 232 | + PETAB_C.ESTIMATE: {"strategy": USE_DEFAULT, DEFAULT_VALUE: 1}, |
| 233 | + PETAB_C.NOMINAL_VALUE: {"strategy": SBML_LOOK}, |
198 | 234 | } |
199 | 235 | DEFAULT_COND_CONFIG = { |
200 | | - C.CONDITION_ID: {"strategy": USE_DEFAULT, DEFAULT_VALUE: "new_condition"}, |
201 | | - C.CONDITION_NAME: {"strategy": COPY_FROM, SOURCE_COLUMN: C.CONDITION_ID}, |
| 236 | + PETAB_C.CONDITION_ID: { |
| 237 | + "strategy": USE_DEFAULT, |
| 238 | + DEFAULT_VALUE: "new_condition", |
| 239 | + }, |
| 240 | + PETAB_C.CONDITION_NAME: { |
| 241 | + "strategy": COPY_FROM, |
| 242 | + SOURCE_COLUMN: PETAB_C.CONDITION_ID, |
| 243 | + }, |
202 | 244 | } |
203 | 245 | DEFAULT_MEAS_CONFIG = {} |
204 | 246 | DEFAULT_CONFIGS = { |
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