#!/bin/bash # Цветной вывод RED='\033[0;31m' GREEN='\033[0;32m' YELLOW='\033[1;33m' NC='\033[0m' echo -e "${GREEN}=== Реорганизация программы Цифровой помощник биохимика ===${NC}" # Создаём бэкап текущей версии BACKUP_DIR="backup_$(date +%Y%m%d_%H%M%S)" echo -e "${YELLOW}Создание бэкапа в $BACKUP_DIR...${NC}" mkdir -p "$BACKUP_DIR" cp *.py "$BACKUP_DIR/" 2>/dev/null echo -e "${GREEN}✓ Бэкап создан${NC}" # Создаём структуру папок echo -e "${YELLOW}Создание структуры проекта...${NC}" mkdir -p src/models mkdir -p src/views mkdir -p src/controllers mkdir -p src/utils # Файл: src/models/reagent.py cat > src/models/reagent.py << 'EOF' class Reagent: def __init__(self, name: str, percentage: float, unit: str, conversion_factor: float = 1.0): self.name = name self.percentage = percentage self.unit = unit self.conversion_factor = conversion_factor self.dilution_factor = 1.0 def __repr__(self): return f"Reagent(name={self.name}, percentage={self.percentage}, unit={self.unit})" EOF # Файл: src/models/__init__.py cat > src/models/__init__.py << 'EOF' from .reagent import Reagent from .medium_model import MediumModel from .experiment_model import ExperimentModel __all__ = ['Reagent', 'MediumModel', 'ExperimentModel'] EOF # Файл: src/models/medium_model.py cat > src/models/medium_model.py << 'EOF' import json from typing import List, Tuple from .reagent import Reagent VOLUME_UNITS = { 'нл': 0.001, 'мкл': 1.0, 'мл': 1000.0, 'л': 1000000.0 } MASS_UNITS = { 'нг': 0.000001, 'мкг': 0.001, 'мг': 1.0, 'г': 1000.0, 'кг': 1000000.0 } class MediumModel: def __init__(self): self.total_amount = 100.0 self.amount_unit = 'мл' self.solvent = 'Вода' self.reagents = [] def convert_amount(self, amount_base: float, target_unit: str, is_volume: bool) -> float: if is_volume: conversion_factor = VOLUME_UNITS.get(target_unit, 1.0) else: conversion_factor = MASS_UNITS.get(target_unit, 1.0) return amount_base / conversion_factor def calculate_amounts(self) -> Tuple[List[float], float, float]: results = [] if not self.reagents: return results, self.total_amount, 100.0 total_percentage = sum(r.percentage for r in self.reagents) if total_percentage > 100: raise ValueError(f"Сумма процентов реагентов ({total_percentage:.2f}%) превышает 100%") total_in_base = self.total_amount * VOLUME_UNITS[self.amount_unit] undiluted_amounts = [] for reagent in self.reagents: amount_in_base = (reagent.percentage / 100) * total_in_base is_volume = reagent.unit in VOLUME_UNITS adjusted_amount = amount_in_base * reagent.conversion_factor final_amount = self.convert_amount(adjusted_amount, reagent.unit, is_volume) undiluted_amounts.append(final_amount) diluted_amounts = [] total_diluted_volume_base = 0 for i, reagent in enumerate(self.reagents): dilution_factor = getattr(reagent, 'dilution_factor', 1.0) if dilution_factor <= 0: dilution_factor = 1.0 diluted_amount = undiluted_amounts[i] * dilution_factor diluted_amounts.append(diluted_amount) is_volume = reagent.unit in VOLUME_UNITS if is_volume: reagent_volume_base = diluted_amount * VOLUME_UNITS[reagent.unit] else: reagent_volume_base = 0 total_diluted_volume_base += reagent_volume_base solvent_volume_base = total_in_base - total_diluted_volume_base solvent_amount = solvent_volume_base / VOLUME_UNITS[self.amount_unit] if solvent_amount < 0: solvent_amount = 0 solvent_percentage = 100 - total_percentage return diluted_amounts, solvent_amount, solvent_percentage def save_to_file(self, filename: str): data = { 'total_amount': self.total_amount, 'amount_unit': self.amount_unit, 'solvent': self.solvent, 'reagents': [{'name': r.name, 'percentage': r.percentage, 'unit': r.unit, 'conversion_factor': r.conversion_factor, 'dilution_factor': getattr(r, 'dilution_factor', 1.0)} for r in self.reagents] } with open(filename, 'w', encoding='utf-8') as f: json.dump(data, f, ensure_ascii=False, indent=4) def load_from_file(self, filename: str): with open(filename, 'r', encoding='utf-8') as f: data = json.load(f) self.total_amount = data['total_amount'] self.amount_unit = data['amount_unit'] self.solvent = data['solvent'] self.reagents.clear() for r_data in data['reagents']: reagent = Reagent(r_data['name'], r_data['percentage'], r_data['unit'], r_data.get('conversion_factor', 1.0)) reagent.dilution_factor = r_data.get('dilution_factor', 1.0) self.reagents.append(reagent) def add_reagent(self, name: str, percentage: float, unit: str, conversion_factor: float = 1.0, dilution_factor: float = 1.0): reagent = Reagent(name, percentage, unit, conversion_factor) reagent.dilution_factor = dilution_factor self.reagents.append(reagent) def remove_reagent(self, index: int): if 0 <= index < len(self.reagents): del self.reagents[index] def clear_reagents(self): self.reagents.clear() def get_reagent_count(self) -> int: return len(self.reagents) def set_total_amount(self, amount: float, unit: str): self.total_amount = amount self.amount_unit = unit def set_solvent(self, solvent_name: str): self.solvent = solvent_name EOF # Файл: src/models/experiment_model.py cat > src/models/experiment_model.py << 'EOF' import numpy as np from typing import List, Dict, Any class ExperimentModel: def __init__(self): self.factors = [] self.responses = [] self.center_points = 3 self.randomize = True def set_factors(self, factors: List[Dict]): self.factors = factors def set_responses(self, responses: List[Dict]): self.responses = responses def set_center_points(self, n: int): self.center_points = n def set_randomize(self, value: bool): self.randomize = value def calculate_factorial_design(self) -> List[Dict]: k = len(self.factors) if k == 0: return [] n_factorial = 2 ** k design = [] for i in range(n_factorial): experiment = {} for j in range(k): coded_level = -1 if (i >> (k - 1 - j)) & 1 == 0 else 1 natural_value = self.factors[j]['low'] if coded_level == -1 else self.factors[j]['high'] experiment[f"Фактор_{j+1}"] = { 'coded': coded_level, 'natural': natural_value, 'name': self.factors[j]['name'], 'unit': self.factors[j]['unit'] } design.append(experiment) for i in range(self.center_points): center_experiment = {} for j in range(k): center_experiment[f"Фактор_{j+1}"] = { 'coded': 0, 'natural': self.factors[j]['center'], 'name': self.factors[j]['name'], 'unit': self.factors[j]['unit'] } center_experiment['is_center'] = True center_experiment['center_num'] = i + 1 design.append(center_experiment) if self.randomize: import random random.shuffle(design) return design def analyze_results(self, results: List[List[float]], design: List[Dict]) -> Dict: analysis = {} for resp_idx, response in enumerate(self.responses): resp_name = response.get('name', f'Отклик_{resp_idx+1}') y_values = [results[i][resp_idx] for i in range(len(results))] mean_y = np.mean(y_values) variance = np.var(y_values, ddof=1) if len(y_values) > 1 else 0 std_dev = np.std(y_values, ddof=1) if len(y_values) > 1 else 0 cv = (std_dev / mean_y) * 100 if mean_y != 0 else 0 factorial_y = [] center_y = [] for i, exp in enumerate(design): if exp.get('is_center', False): center_y.append(y_values[i]) else: factorial_y.append(y_values[i]) center_variance = np.var(center_y, ddof=1) if len(center_y) > 1 else 0 analysis[resp_name] = { 'mean': mean_y, 'variance': variance, 'std_dev': std_dev, 'cv': cv, 'factorial_values': factorial_y, 'center_values': center_y, 'center_variance': center_variance, 'n_factorial': len(factorial_y), 'n_center': len(center_y) } return analysis EOF # Файл: src/views/__init__.py cat > src/views/__init__.py << 'EOF' from .main_window import MainWindow from .medium_view import MediumCalculatorWindow from .experiment_view import ExperimentDesignWindow __all__ = ['MainWindow', 'MediumCalculatorWindow', 'ExperimentDesignWindow'] EOF # Файл: src/views/main_window.py cat > src/views/main_window.py << 'EOF' from PyQt5.QtWidgets import (QMainWindow, QVBoxLayout, QHBoxLayout, QPushButton, QLabel, QWidget, QFrame) from PyQt5.QtCore import Qt from PyQt5.QtGui import QFont class MainWindow(QMainWindow): def __init__(self): super().__init__() self.setWindowTitle("Цифровой помощник биохимика - Главное меню") self.setGeometry(300, 200, 700, 500) self.setStyleSheet(""" QMainWindow { background-color: qlineargradient(x1:0, y1:0, x2:1, y2:1, stop:0 #e8f4f8, stop:1 #f0f0f0); } QPushButton { background-color: #2196F3; color: white; border: none; padding: 15px; font-size: 16px; font-weight: bold; border-radius: 8px; } QPushButton:hover { background-color: #1976D2; } QLabel { color: #333; font-size: 14px; } """) self._init_ui() self.medium_calculator = None self.experiment_window = None def _init_ui(self): central_widget = QWidget() self.setCentralWidget(central_widget) layout = QVBoxLayout(central_widget) layout.setSpacing(20) layout.setContentsMargins(50, 50, 50, 50) title_label = QLabel("Цифровой помощник биохимика") title_font = QFont() title_font.setPointSize(20) title_font.setBold(True) title_label.setFont(title_font) title_label.setAlignment(Qt.AlignCenter) title_label.setStyleSheet("color: #1565C0;") layout.addWidget(title_label) subtitle_label = QLabel("Биотехнологические инструменты для лаборатории") subtitle_font = QFont() subtitle_font.setPointSize(12) subtitle_label.setFont(subtitle_font) subtitle_label.setAlignment(Qt.AlignCenter) subtitle_label.setStyleSheet("color: #666;") layout.addWidget(subtitle_label) layout.addSpacing(20) btn_medium = QPushButton("🧪 Калькулятор питательных сред") btn_medium.setMinimumHeight(80) btn_medium.clicked.connect(self.open_medium_calculator) layout.addWidget(btn_medium) desc1_label = QLabel("Расчёт состава питательной среды с учётом процентного содержания,\nразбавления реагентов и автоматическим расчётом растворителя") desc1_label.setAlignment(Qt.AlignCenter) desc1_label.setWordWrap(True) desc1_label.setStyleSheet("color: #555; font-size: 11px;") layout.addWidget(desc1_label) layout.addSpacing(15) btn_experiment = QPushButton("📊 Планирование эксперимента (DoE)") btn_experiment.setMinimumHeight(80) btn_experiment.clicked.connect(self.open_experiment_designer) layout.addWidget(btn_experiment) desc2_label = QLabel("Дизайн эксперимента, оптимизация процессов,\nмногомерный анализ и визуализация") desc2_label.setAlignment(Qt.AlignCenter) desc2_label.setWordWrap(True) desc2_label.setStyleSheet("color: #555; font-size: 11px;") layout.addWidget(desc2_label) layout.addSpacing(15) line = QFrame() line.setFrameShape(QFrame.HLine) line.setFrameShadow(QFrame.Sunken) layout.addWidget(line) bottom_layout = QHBoxLayout() version_label = QLabel("Версия 1.0.0 | © 2026 Цифровой помощник биохимика") version_label.setStyleSheet("color: #999; font-size: 10px;") bottom_layout.addWidget(version_label) bottom_layout.addStretch() btn_exit = QPushButton("Выход") btn_exit.setMaximumWidth(150) btn_exit.setStyleSheet("QPushButton { background-color: #f44336; padding: 8px; font-size: 14px; } QPushButton:hover { background-color: #da190b; }") btn_exit.clicked.connect(self.close) bottom_layout.addWidget(btn_exit) layout.addLayout(bottom_layout) def open_medium_calculator(self): from .medium_view import MediumCalculatorWindow from ..controllers.medium_controller import MediumController self.medium_calculator = MediumCalculatorWindow() self.medium_controller = MediumController(self.medium_calculator) self.medium_calculator.show() def open_experiment_designer(self): from .experiment_view import ExperimentDesignWindow from ..controllers.experiment_controller import ExperimentController self.experiment_window = ExperimentDesignWindow() self.experiment_controller = ExperimentController(self.experiment_window) self.experiment_window.show() EOF # Файл: src/views/medium_view.py cat > src/views/medium_view.py << 'EOF' from PyQt5.QtWidgets import (QMainWindow, QVBoxLayout, QHBoxLayout, QTableWidget, QTableWidgetItem, QPushButton, QLabel, QDoubleSpinBox, QComboBox, QLineEdit, QWidget, QMessageBox, QGroupBox, QFrame) from PyQt5.QtCore import Qt from PyQt5.QtGui import QFont, QColor class MediumCalculatorWindow(QMainWindow): def __init__(self): super().__init__() self.setWindowTitle("Калькулятор питательных сред") self.setGeometry(200, 100, 1200, 700) self.setStyleSheet(""" QMainWindow { background-color: #f5f5f5; } QGroupBox { font-weight: bold; border: 2px solid #ccc; border-radius: 5px; margin-top: 10px; padding-top: 10px; background-color: white; } QGroupBox::title { subcontrol-origin: margin; left: 10px; padding: 0 5px 0 5px; color: #1565C0; } QPushButton { background-color: #2196F3; color: white; border: none; padding: 8px 15px; border-radius: 4px; font-weight: bold; } QPushButton:hover { background-color: #1976D2; } QPushButton#danger { background-color: #f44336; } QPushButton#success { background-color: #4CAF50; } QTableWidget { gridline-color: #ddd; background-color: white; } QHeaderView::section { background-color: #1565C0; color: white; padding: 8px; font-weight: bold; } """) self._init_ui() def _init_ui(self): central_widget = QWidget() self.setCentralWidget(central_widget) layout = QVBoxLayout(central_widget) layout.setSpacing(15) layout.setContentsMargins(20, 20, 20, 20) title_label = QLabel("Калькулятор питательных сред") title_label.setAlignment(Qt.AlignCenter) title_font = QFont() title_font.setPointSize(18) title_font.setBold(True) title_label.setFont(title_font) layout.addWidget(title_label) params_group = QGroupBox("Параметры среды") params_layout = QHBoxLayout() amount_layout = QHBoxLayout() amount_layout.addWidget(QLabel("Общее количество:")) self.amount_input = QDoubleSpinBox() self.amount_input.setRange(0.001, 1000000.0) self.amount_input.setValue(1000.0) amount_layout.addWidget(self.amount_input) self.amount_unit_combo = QComboBox() self.amount_unit_combo.addItems(["нл", "мкл", "мл", "л"]) self.amount_unit_combo.setCurrentText("мл") amount_layout.addWidget(self.amount_unit_combo) params_layout.addLayout(amount_layout) solvent_layout = QHBoxLayout() solvent_layout.addWidget(QLabel("Растворитель:")) self.solvent_input = QLineEdit("Вода") solvent_layout.addWidget(self.solvent_input) params_layout.addLayout(solvent_layout) params_layout.addStretch() params_group.setLayout(params_layout) layout.addWidget(params_group) table_group = QGroupBox("Состав среды") table_layout = QVBoxLayout() self.table = QTableWidget() self.table.setColumnCount(6) self.table.setHorizontalHeaderLabels(["Название", "%", "Единица", "Коэфф.", "Разбавление (x)", "Количество"]) self.table.setAlternatingRowColors(True) self.table.setSelectionBehavior(QTableWidget.SelectRows) self.table.setColumnWidth(0, 180) self.table.setColumnWidth(1, 70) self.table.setColumnWidth(2, 90) self.table.setColumnWidth(3, 70) self.table.setColumnWidth(4, 100) self.table.setColumnWidth(5, 120) table_layout.addWidget(self.table) table_group.setLayout(table_layout) layout.addWidget(table_group) btn_group = QGroupBox("Управление") btn_layout = QHBoxLayout() self.add_row_btn = QPushButton("➕ Добавить реагент") self.remove_row_btn = QPushButton("➖ Удалить реагент") self.remove_row_btn.setObjectName("danger") btn_layout.addWidget(self.add_row_btn) btn_layout.addWidget(self.remove_row_btn) btn_layout.addStretch() self.calculate_btn = QPushButton("🧮 Рассчитать") self.calculate_btn.setObjectName("success") self.save_btn = QPushButton("💾 Сохранить") self.load_btn = QPushButton("📂 Загрузить") btn_layout.addWidget(self.calculate_btn) btn_layout.addWidget(self.save_btn) btn_layout.addWidget(self.load_btn) btn_group.setLayout(btn_layout) layout.addWidget(btn_group) info_frame = QFrame() info_frame.setFrameShape(QFrame.StyledPanel) info_frame.setStyleSheet("background-color: #e3f2fd; border-radius: 5px;") info_layout = QHBoxLayout(info_frame) info_label = QLabel("ℹ️ Подсказка: Реагенты в массовых единицах не учитываются при расчёте объёма растворителя") info_layout.addWidget(info_label) info_layout.addStretch() layout.addWidget(info_frame) def add_initial_rows(self): self.add_solvent_row() self.add_new_row() def add_solvent_row(self): row = self.table.rowCount() self.table.insertRow(row) solvent_item = QTableWidgetItem(self.solvent_input.text()) solvent_item.setFlags(solvent_item.flags() & ~Qt.ItemIsEditable) solvent_item.setBackground(QColor(230, 230, 230)) font = QFont() font.setBold(True) solvent_item.setFont(font) self.table.setItem(row, 0, solvent_item) for col in [1, 3, 4]: item = QTableWidgetItem("-") item.setFlags(item.flags() & ~Qt.ItemIsEditable) item.setBackground(QColor(230, 230, 230)) self.table.setItem(row, col, item) unit_item = QTableWidgetItem(self.amount_unit_combo.currentText()) unit_item.setFlags(unit_item.flags() & ~Qt.ItemIsEditable) unit_item.setBackground(QColor(230, 230, 230)) self.table.setItem(row, 2, unit_item) result_item = QTableWidgetItem("") result_item.setFlags(result_item.flags() & ~Qt.ItemIsEditable) self.table.setItem(row, 5, result_item) def update_solvent_name(self): if self.table.rowCount() > 0 and self.table.item(0, 0): self.table.item(0, 0).setText(self.solvent_input.text()) def add_new_row(self): row = self.table.rowCount() self.table.insertRow(row) self.table.setItem(row, 0, QTableWidgetItem(f"Реагент_{row}")) self.table.setItem(row, 1, QTableWidgetItem("0")) unit_combo = QComboBox() unit_combo.addItems(["нг", "мкг", "мг", "г", "кг", "нл", "мкл", "мл", "л"]) unit_combo.setCurrentText("мг") self.table.setCellWidget(row, 2, unit_combo) self.table.setItem(row, 3, QTableWidgetItem("1")) self.table.setItem(row, 4, QTableWidgetItem("1")) self.table.setItem(row, 5, QTableWidgetItem("")) def remove_selected_row(self): for row in sorted(set(item.row() for item in self.table.selectedItems()), reverse=True): if row > 0: self.table.removeRow(row) def get_table_data(self): data = [] for row in range(1, self.table.rowCount()): name = self.table.item(row, 0).text() if self.table.item(row, 0) else "" percent = self.table.item(row, 1).text() if self.table.item(row, 1) else "0" unit_widget = self.table.cellWidget(row, 2) unit = unit_widget.currentText() if unit_widget else "мг" coeff = self.table.item(row, 3).text() if self.table.item(row, 3) else "1" dilution = self.table.item(row, 4).text() if self.table.item(row, 4) else "1" data.append([name, percent, unit, coeff, dilution]) return data def update_solvent_percent(self, solvent_percent: float): if self.table.rowCount() > 0 and self.table.item(0, 1): self.table.item(0, 1).setText(self.format_number(solvent_percent)) def update_solvent_result(self, solvent_amount: float, unit: str): if self.table.rowCount() > 0: if self.table.item(0, 5): self.table.item(0, 5).setText(self.format_number(solvent_amount)) self.table.item(0, 5).setBackground(QColor(220, 255, 220)) if self.table.item(0, 2): self.table.item(0, 2).setText(unit) def update_results(self, results: list): for row, amount in enumerate(results, start=1): if row < self.table.rowCount() and self.table.item(row, 5): self.table.item(row, 5).setText(self.format_number(amount)) self.table.item(row, 5).setBackground(QColor(220, 255, 220)) def clear_results(self): for row in range(self.table.rowCount()): if self.table.item(row, 5): self.table.item(row, 5).setText("") if row == 0: self.table.item(row, 5).setBackground(QColor(230, 230, 230)) else: self.table.item(row, 5).setBackground(QColor(250, 250, 250)) if self.table.rowCount() > 0 and self.table.item(0, 1): self.table.item(0, 1).setText("") if self.table.rowCount() > 0 and self.table.item(0, 2): self.table.item(0, 2).setText(self.amount_unit_combo.currentText()) def format_number(self, value): if value == int(value): return str(int(value)) formatted = f"{value:.6f}".rstrip('0').rstrip('.') if '.' in formatted and len(formatted.split('.')[1]) > 4: formatted = f"{value:.4f}".rstrip('0').rstrip('.') return formatted def show_error(self, message: str): QMessageBox.critical(self, "Ошибка", message) EOF # Файл: src/views/experiment_view.py (полная версия) cat > src/views/experiment_view.py << 'EOF' from PyQt5.QtWidgets import (QMainWindow, QVBoxLayout, QHBoxLayout, QPushButton, QLabel, QWidget, QMessageBox, QTableWidget, QTableWidgetItem, QGroupBox, QSpinBox, QDoubleSpinBox, QComboBox, QLineEdit, QTextEdit, QTabWidget, QFormLayout, QCheckBox, QScrollArea, QFileDialog) from PyQt5.QtCore import Qt from PyQt5.QtGui import QColor, QFont import csv import random import numpy as np class ExperimentDesignWindow(QMainWindow): def __init__(self): super().__init__() self.setWindowTitle("Планирование эксперимента - Цифровой помощник биохимика") self.setGeometry(200, 100, 1200, 800) self.setStyleSheet(""" QMainWindow { background-color: #f5f5f5; } QGroupBox { font-weight: bold; border: 2px solid #ccc; border-radius: 5px; margin-top: 10px; padding-top: 10px; } QGroupBox::title { subcontrol-origin: margin; left: 10px; padding: 0 5px 0 5px; color: #1565C0; } QPushButton { background-color: #4CAF50; color: white; border: none; padding: 8px; border-radius: 4px; font-weight: bold; } QPushButton:hover { background-color: #45a049; } QPushButton#danger { background-color: #f44336; } QPushButton#danger:hover { background-color: #da190b; } QTableWidget { gridline-color: #ddd; } QHeaderView::section { background-color: #1565C0; color: white; padding: 8px; font-weight: bold; } """) self._init_ui() def _init_ui(self): central_widget = QWidget() self.setCentralWidget(central_widget) layout = QVBoxLayout(central_widget) title_label = QLabel("Планирование полнофакторного эксперимента (DoE)") title_font = QFont() title_font.setPointSize(18) title_font.setBold(True) title_label.setFont(title_font) title_label.setAlignment(Qt.AlignCenter) title_label.setStyleSheet("color: #2E7D32;") layout.addWidget(title_label) tabs = QTabWidget() # Вкладка параметров params_tab = QWidget() params_layout = QVBoxLayout(params_tab) factors_group = QGroupBox("Факторы эксперимента (независимые переменные)") factors_layout = QVBoxLayout() info_label = QLabel("Определите факторы, которые влияют на ваш эксперимент:") info_label.setStyleSheet("color: #555; font-weight: normal;") factors_layout.addWidget(info_label) self.factors_table = QTableWidget() self.factors_table.setColumnCount(6) self.factors_table.setHorizontalHeaderLabels(["Фактор", "Нулевой уровень (0)", "Шаг", "Верхний уровень (+1)", "Нижний уровень (-1)", "Единица измерения"]) self.factors_table.setRowCount(2) sample_factors = [["Температура", "31", "6", "37", "25", "°C"], ["pH", "7.0", "0.5", "7.5", "6.5", ""]] for i, factor in enumerate(sample_factors): for j, value in enumerate(factor): item = QTableWidgetItem(value) if j in [3, 4]: item.setFlags(item.flags() & ~Qt.ItemIsEditable) item.setBackground(QColor(240, 240, 240)) self.factors_table.setItem(i, j, item) self.factors_table.setColumnWidth(0, 150) self.factors_table.setColumnWidth(1, 120) self.factors_table.setColumnWidth(2, 80) self.factors_table.setColumnWidth(3, 120) self.factors_table.setColumnWidth(4, 120) self.factors_table.setColumnWidth(5, 100) self.factors_table.itemChanged.connect(self.on_factor_changed) factors_layout.addWidget(self.factors_table) factor_buttons = QHBoxLayout() add_factor_btn = QPushButton("+ Добавить фактор") add_factor_btn.clicked.connect(self.add_factor_row) remove_factor_btn = QPushButton("- Удалить последний") remove_factor_btn.clicked.connect(self.remove_factor_row) factor_buttons.addWidget(add_factor_btn) factor_buttons.addWidget(remove_factor_btn) factor_buttons.addStretch() factors_layout.addLayout(factor_buttons) factors_group.setLayout(factors_layout) params_layout.addWidget(factors_group) settings_group = QGroupBox("Настройки эксперимента") settings_layout = QHBoxLayout() center_layout = QHBoxLayout() center_layout.addWidget(QLabel("Количество центральных точек:")) self.center_points_spin = QSpinBox() self.center_points_spin.setRange(0, 10) self.center_points_spin.setValue(3) center_layout.addWidget(self.center_points_spin) settings_layout.addLayout(center_layout) self.randomize_check = QCheckBox("Рэндомизировать порядок опытов") self.randomize_check.setChecked(True) settings_layout.addWidget(self.randomize_check) settings_layout.addStretch() settings_group.setLayout(settings_layout) params_layout.addWidget(settings_group) responses_group = QGroupBox("Отклики (зависимые переменные)") responses_layout = QVBoxLayout() self.responses_table = QTableWidget() self.responses_table.setColumnCount(2) self.responses_table.setHorizontalHeaderLabels(["Отклик", "Единица измерения"]) self.responses_table.setRowCount(2) sample_responses = [["Оптическая плотность (OD600)", ""], ["Концентрация целевого продукта", "мг/мл"]] for i, response in enumerate(sample_responses): for j, value in enumerate(response): self.responses_table.setItem(i, j, QTableWidgetItem(value)) responses_layout.addWidget(self.responses_table) response_buttons = QHBoxLayout() add_response_btn = QPushButton("+ Добавить отклик") add_response_btn.clicked.connect(self.add_response_row) remove_response_btn = QPushButton("- Удалить последний") remove_response_btn.clicked.connect(self.remove_response_row) response_buttons.addWidget(add_response_btn) response_buttons.addWidget(remove_response_btn) response_buttons.addStretch() responses_layout.addLayout(response_buttons) responses_group.setLayout(responses_layout) params_layout.addWidget(responses_group) tabs.addTab(params_tab, "📝 Параметры эксперимента") # Вкладка матрицы планирования plan_tab = QWidget() plan_layout = QVBoxLayout(plan_tab) plan_info = QLabel("Полнофакторный план эксперимента с центральными точками") plan_info.setAlignment(Qt.AlignCenter) plan_info.setStyleSheet("font-weight: bold; font-size: 14px; padding: 10px;") plan_layout.addWidget(plan_info) scroll = QScrollArea() scroll.setWidgetResizable(True) matrix_widget = QWidget() matrix_layout = QVBoxLayout(matrix_widget) self.design_matrix = QTableWidget() matrix_layout.addWidget(self.design_matrix) scroll.setWidget(matrix_widget) plan_layout.addWidget(scroll) buttons_layout = QHBoxLayout() generate_btn = QPushButton("Сгенерировать план эксперимента") generate_btn.clicked.connect(self.generate_design_matrix) buttons_layout.addWidget(generate_btn) export_btn = QPushButton("📊 Экспорт в CSV") export_btn.clicked.connect(self.export_to_csv) buttons_layout.addWidget(export_btn) buttons_layout.addStretch() plan_layout.addLayout(buttons_layout) self.plan_info_label = QLabel("") self.plan_info_label.setStyleSheet("color: #666; font-size: 12px; padding: 5px;") plan_layout.addWidget(self.plan_info_label) tabs.addTab(plan_tab, "📊 Матрица планирования") # Вкладка анализа analysis_tab = QWidget() analysis_layout = QVBoxLayout(analysis_tab) analysis_info = QLabel("Введите результаты экспериментов для анализа") analysis_info.setAlignment(Qt.AlignCenter) analysis_info.setStyleSheet("font-weight: bold; font-size: 14px; padding: 10px;") analysis_layout.addWidget(analysis_info) self.results_table = QTableWidget() analysis_layout.addWidget(self.results_table) analyze_btn = QPushButton("Провести регрессионный анализ") analyze_btn.clicked.connect(self.perform_analysis) analysis_layout.addWidget(analyze_btn) self.analysis_output = QTextEdit() self.analysis_output.setReadOnly(True) self.analysis_output.setMaximumHeight(200) analysis_layout.addWidget(self.analysis_output) tabs.addTab(analysis_tab, "📈 Анализ результатов") layout.addWidget(tabs) btn_layout = QHBoxLayout() close_btn = QPushButton("Закрыть") close_btn.clicked.connect(self.close) btn_layout.addStretch() btn_layout.addWidget(close_btn) layout.addLayout(btn_layout) self.generated_design = None self.factors_data = None def on_factor_changed(self, item): row = item.row() col = item.column() if col in [1, 2]: try: center = float(self.factors_table.item(row, 1).text()) if self.factors_table.item(row, 1) else 0 step = float(self.factors_table.item(row, 2).text()) if self.factors_table.item(row, 2) else 0 high = center + step low = center - step self.factors_table.blockSignals(True) if self.factors_table.item(row, 3): self.factors_table.item(row, 3).setText(f"{high:.3f}".rstrip('0').rstrip('.')) if self.factors_table.item(row, 4): self.factors_table.item(row, 4).setText(f"{low:.3f}".rstrip('0').rstrip('.')) self.factors_table.blockSignals(False) except ValueError: pass def add_factor_row(self): row = self.factors_table.rowCount() self.factors_table.insertRow(row) self.factors_table.setItem(row, 0, QTableWidgetItem(f"Фактор_{row+1}")) self.factors_table.setItem(row, 1, QTableWidgetItem("0")) self.factors_table.setItem(row, 2, QTableWidgetItem("1")) high_item = QTableWidgetItem("1") high_item.setFlags(high_item.flags() & ~Qt.ItemIsEditable) high_item.setBackground(QColor(240, 240, 240)) self.factors_table.setItem(row, 3, high_item) low_item = QTableWidgetItem("-1") low_item.setFlags(low_item.flags() & ~Qt.ItemIsEditable) low_item.setBackground(QColor(240, 240, 240)) self.factors_table.setItem(row, 4, low_item) self.factors_table.setItem(row, 5, QTableWidgetItem("")) def remove_factor_row(self): if self.factors_table.rowCount() > 1: self.factors_table.removeRow(self.factors_table.rowCount() - 1) def add_response_row(self): row = self.responses_table.rowCount() self.responses_table.insertRow(row) self.responses_table.setItem(row, 0, QTableWidgetItem(f"Отклик_{row+1}")) self.responses_table.setItem(row, 1, QTableWidgetItem("")) def remove_response_row(self): if self.responses_table.rowCount() > 1: self.responses_table.removeRow(self.responses_table.rowCount() - 1) def get_factors_data(self): factors = [] for row in range(self.factors_table.rowCount()): try: factor = { 'name': self.factors_table.item(row, 0).text() if self.factors_table.item(row, 0) else "", 'center': float(self.factors_table.item(row, 1).text()) if self.factors_table.item(row, 1) else 0, 'step': float(self.factors_table.item(row, 2).text()) if self.factors_table.item(row, 2) else 0, 'high': float(self.factors_table.item(row, 3).text()) if self.factors_table.item(row, 3) else 0, 'low': float(self.factors_table.item(row, 4).text()) if self.factors_table.item(row, 4) else 0, 'unit': self.factors_table.item(row, 5).text() if self.factors_table.item(row, 5) else "" } factors.append(factor) except (ValueError, AttributeError): continue return factors def calculate_factorial_design(self, factors): k = len(factors) if k == 0: return [] n_factorial = 2 ** k design = [] for i in range(n_factorial): experiment = {} for j in range(k): coded_level = -1 if (i >> (k - 1 - j)) & 1 == 0 else 1 natural_value = factors[j]['low'] if coded_level == -1 else factors[j]['high'] experiment[f"Фактор_{j+1}"] = { 'coded': coded_level, 'natural': natural_value, 'name': factors[j]['name'], 'unit': factors[j]['unit'] } design.append(experiment) n_center = self.center_points_spin.value() for i in range(n_center): center_experiment = {} for j in range(k): center_experiment[f"Фактор_{j+1}"] = { 'coded': 0, 'natural': factors[j]['center'], 'name': factors[j]['name'], 'unit': factors[j]['unit'] } center_experiment['is_center'] = True center_experiment['center_num'] = i + 1 design.append(center_experiment) if self.randomize_check.isChecked(): random.shuffle(design) return design def generate_design_matrix(self): factors = self.get_factors_data() if len(factors) == 0: QMessageBox.warning(self, "Предупреждение", "Добавьте хотя бы один фактор!") return self.factors_data = factors design = self.calculate_factorial_design(factors) self.generated_design = design n_experiments = len(design) n_factors = len(factors) self.design_matrix.setRowCount(n_experiments) self.design_matrix.setColumnCount(n_factors + 2) headers = ["№ опыта"] + [f["name"] for f in factors] + ["Тип точки"] self.design_matrix.setHorizontalHeaderLabels(headers) for exp_idx, experiment in enumerate(design): self.design_matrix.setItem(exp_idx, 0, QTableWidgetItem(str(exp_idx + 1))) for factor_idx in range(n_factors): factor_key = f"Фактор_{factor_idx + 1}" value = experiment[factor_key]['natural'] unit = factors[factor_idx]['unit'] if isinstance(value, float): if value == int(value): display_value = str(int(value)) else: display_value = f"{value:.3f}".rstrip('0').rstrip('.') else: display_value = str(value) if unit: display_value += f" {unit}" item = QTableWidgetItem(display_value) if experiment.get('is_center', False): item.setBackground(QColor(255, 255, 200)) self.design_matrix.setItem(exp_idx, factor_idx + 1, item) if experiment.get('is_center', False): type_item = QTableWidgetItem(f"Центральная #{experiment['center_num']}") type_item.setBackground(QColor(255, 255, 200)) else: levels = [] for factor_idx in range(n_factors): factor_key = f"Фактор_{factor_idx + 1}" coded = experiment[factor_key]['coded'] levels.append("+" if coded == 1 else "-") type_item = QTableWidgetItem(f"Факторная ({''.join(levels)})") self.design_matrix.setItem(exp_idx, n_factors + 1, type_item) self.design_matrix.resizeColumnsToContents() n_factorial = 2 ** n_factors n_center = self.center_points_spin.value() self.plan_info_label.setText(f"📊 План эксперимента: {n_factorial} факторных точек + {n_center} центральных точек = {n_experiments} опытов") self.setup_results_table(n_experiments) QMessageBox.information(self, "Успех", f"Сгенерирован план для {n_factors} факторов\nФакторных точек: {n_factorial}\nЦентральных точек: {n_center}\nВсего опытов: {n_experiments}") def setup_results_table(self, n_experiments): n_responses = self.responses_table.rowCount() self.results_table.setRowCount(n_experiments) self.results_table.setColumnCount(n_responses + 1) headers = ["№ опыта"] + [self.responses_table.item(i, 0).text() if self.responses_table.item(i, 0) else f"Отклик_{i+1}" for i in range(n_responses)] self.results_table.setHorizontalHeaderLabels(headers) for i in range(n_experiments): self.results_table.setItem(i, 0, QTableWidgetItem(str(i + 1))) self.results_table.setColumnWidth(0, 80) for i in range(n_responses): self.results_table.setColumnWidth(i + 1, 150) def export_to_csv(self): if self.design_matrix.rowCount() == 0: QMessageBox.warning(self, "Предупреждение", "Сначала сгенерируйте план эксперимента!") return filename, _ = QFileDialog.getSaveFileName(self, "Сохранить план эксперимента", "", "CSV Files (*.csv);;All Files (*)") if filename: if not filename.lower().endswith('.csv'): filename += '.csv' try: with open(filename, 'w', newline='', encoding='utf-8-sig') as f: writer = csv.writer(f) headers = [] for j in range(self.design_matrix.columnCount()): header_item = self.design_matrix.horizontalHeaderItem(j) headers.append(header_item.text() if header_item else f"Колонка_{j+1}") writer.writerow(headers) for i in range(self.design_matrix.rowCount()): row = [self.design_matrix.item(i, j).text() if self.design_matrix.item(i, j) else "" for j in range(self.design_matrix.columnCount())] writer.writerow(row) QMessageBox.information(self, "Успех", f"План эксперимента сохранен в {filename}") except Exception as e: QMessageBox.critical(self, "Ошибка", f"Не удалось сохранить файл: {str(e)}") def perform_analysis(self): n_responses = self.responses_table.rowCount() if n_responses == 0: QMessageBox.warning(self, "Предупреждение", "Добавьте хотя бы один отклик!") return if self.generated_design is None: QMessageBox.warning(self, "Предупреждение", "Сначала сгенерируйте план эксперимента!") return results = [] for i in range(self.results_table.rowCount()): row_results = [] for j in range(1, self.results_table.columnCount()): item = self.results_table.item(i, j) if item and item.text(): try: row_results.append(float(item.text())) except ValueError: row_results.append(None) else: row_results.append(None) results.append(row_results) for i, row in enumerate(results): for j, val in enumerate(row): if val is None: self.analysis_output.setText(f"Ошибка: Не введены результаты для опыта {i+1}, отклик {j+1}") return self.analysis_output.clear() self.analysis_output.append("=" * 60) self.analysis_output.append("РЕЗУЛЬТАТЫ РЕГРЕССИОННОГО АНАЛИЗА") self.analysis_output.append("=" * 60) factors = self.get_factors_data() design = self.generated_design for resp_idx in range(n_responses): resp_name = self.responses_table.item(resp_idx, 0).text() self.analysis_output.append(f"\n📊 Отклик: {resp_name}") self.analysis_output.append("-" * 40) y_values = [results[i][resp_idx] for i in range(len(results))] mean_y = np.mean(y_values) variance = np.var(y_values, ddof=1) if len(y_values) > 1 else 0 std_dev = np.std(y_values, ddof=1) if len(y_values) > 1 else 0 cv = (std_dev / mean_y) * 100 if mean_y != 0 else 0 self.analysis_output.append(f"Среднее значение: {mean_y:.4f}") self.analysis_output.append(f"Общая дисперсия: {variance:.4f}") self.analysis_output.append(f"Стандартное отклонение: {std_dev:.4f}") self.analysis_output.append(f"Коэффициент вариации: {cv:.2f}%") factorial_y = [] center_y = [] for i, exp in enumerate(design): if exp.get('is_center', False): center_y.append(y_values[i]) else: factorial_y.append(y_values[i]) if len(center_y) > 1: center_variance = np.var(center_y, ddof=1) if len(center_y) > 1 else 0 self.analysis_output.append(f"\nЦентральные точки (n={len(center_y)}):") self.analysis_output.append(f" Среднее: {np.mean(center_y):.4f}") self.analysis_output.append(f" Дисперсия воспроизводимости: {center_variance:.4f}") if len(factorial_y) > 0 and center_variance > 0: factorial_variance = np.var(factorial_y, ddof=1) if len(factorial_y) > 1 else 0 if factorial_variance > 0: fisher = max(factorial_variance, center_variance) / min(factorial_variance, center_variance) self.analysis_output.append(f"\nКритерий Фишера (F-отношение): {fisher:.4f}") if fisher < 4.0: self.analysis_output.append("✅ Модель адекватна экспериментальным данным") else: self.analysis_output.append("⚠️ Модель может быть неадекватна, требуется проверка") self.analysis_output.append("\n" + "=" * 60) self.analysis_output.append("Анализ завершен") def show_error(self, message: str): QMessageBox.critical(self, "Ошибка", message) EOF # Файл: src/controllers/__init__.py cat > src/controllers/__init__.py << 'EOF' from .medium_controller import MediumController from .experiment_controller import ExperimentController __all__ = ['MediumController', 'ExperimentController'] EOF # Файл: src/controllers/medium_controller.py cat > src/controllers/medium_controller.py << 'EOF' from PyQt5.QtWidgets import QFileDialog, QMessageBox, QTableWidgetItem, QComboBox from PyQt5.QtCore import Qt from PyQt5.QtGui import QColor import json from ..models.medium_model import MediumModel from ..models.reagent import Reagent class MediumController: def __init__(self, view): self.model = MediumModel() self.view = view self._connect_signals() self._setup_initial_data() def _connect_signals(self): self.view.add_row_btn.clicked.connect(self.add_reagent_row) self.view.remove_row_btn.clicked.connect(self.remove_reagent_row) self.view.calculate_btn.clicked.connect(self._perform_calculation) self.view.save_btn.clicked.connect(self.save_composition) self.view.load_btn.clicked.connect(self.load_composition) self.view.solvent_input.textChanged.connect(self.view.update_solvent_name) def _setup_initial_data(self): self.view.add_initial_rows() def add_reagent_row(self): self.view.add_new_row() def remove_reagent_row(self): self.view.remove_selected_row() def _perform_calculation(self): try: self._update_model_from_view() results, solvent_amount, solvent_percentage = self.model.calculate_amounts() self.view.update_results(results) self.view.update_solvent_result(solvent_amount, self.model.amount_unit) self.view.update_solvent_percent(solvent_percentage) except ValueError as e: self.view.show_error(f"Ошибка в данных: {str(e)}") except Exception as e: self.view.show_error(f"Неожиданная ошибка: {str(e)}") def _update_model_from_view(self): self.model.reagents.clear() self.model.total_amount = self.view.amount_input.value() self.model.amount_unit = self.view.amount_unit_combo.currentText() self.model.solvent = self.view.solvent_input.text() for row in range(1, self.view.table.rowCount()): name_item = self.view.table.item(row, 0) percentage_item = self.view.table.item(row, 1) unit_widget = self.view.table.cellWidget(row, 2) conversion_item = self.view.table.item(row, 3) dilution_item = self.view.table.item(row, 4) if not all([name_item, percentage_item, conversion_item]): continue try: name = name_item.text() percentage = float(percentage_item.text()) unit = unit_widget.currentText() if unit_widget else "мг" conversion_factor = float(conversion_item.text()) dilution_factor = float(dilution_item.text()) if dilution_item else 1.0 reagent = Reagent(name, percentage, unit, conversion_factor) reagent.dilution_factor = dilution_factor self.model.reagents.append(reagent) except ValueError as e: raise ValueError(f"Ошибка в строке {row + 1}: {str(e)}") def save_composition(self): filename, _ = QFileDialog.getSaveFileName(self.view, "Сохранить состав среды", "", "JSON Files (*.json);;All Files (*)") if filename: if not filename.lower().endswith('.json'): filename += '.json' try: self._update_model_from_view() self.model.save_to_file(filename) QMessageBox.information(self.view, "Успех", "Состав среды успешно сохранён!") except Exception as e: self.view.show_error(f"Ошибка сохранения: {str(e)}") def load_composition(self): filename, _ = QFileDialog.getOpenFileName(self.view, "Загрузить состав среды", "", "JSON Files (*.json);;All Files (*)") if filename: try: self.model.load_from_file(filename) self._update_view_from_model() QMessageBox.information(self.view, "Успех", "Состав среды успешно загружен") except FileNotFoundError: QMessageBox.critical(self.view, "Ошибка", f"Файл не найден: {filename}") except json.JSONDecodeError as e: QMessageBox.critical(self.view, "Ошибка", f"Неверный формат JSON-файла: {str(e)}") except Exception as e: QMessageBox.critical(self.view, "Ошибка", f"Ошибка при загрузке состава: {str(e)}") def _update_view_from_model(self): while self.view.table.rowCount() > 1: self.view.table.removeRow(1) if self.view.table.rowCount() == 0: self.view.add_solvent_row() self.view.amount_input.setValue(self.model.total_amount) index = self.view.amount_unit_combo.findText(self.model.amount_unit) if index >= 0: self.view.amount_unit_combo.setCurrentIndex(index) self.view.solvent_input.setText(self.model.solvent) self.view.update_solvent_name() for reagent in self.model.reagents: row = self.view.table.rowCount() self.view.table.insertRow(row) self.view.table.setItem(row, 0, QTableWidgetItem(reagent.name)) self.view.table.setItem(row, 1, QTableWidgetItem(f"{reagent.percentage:.2f}")) unit_combo = QComboBox() unit_combo.addItems(["нг", "мкг", "мг", "г", "кг", "нл", "мкл", "мл", "л"]) unit_combo.setCurrentText(reagent.unit) self.view.table.setCellWidget(row, 2, unit_combo) self.view.table.setItem(row, 3, QTableWidgetItem(f"{reagent.conversion_factor:.2f}")) self.view.table.setItem(row, 4, QTableWidgetItem(f"{getattr(reagent, 'dilution_factor', 1.0):.3f}")) self.view.table.setItem(row, 5, QTableWidgetItem("")) self.view.clear_results() EOF # Файл: src/controllers/experiment_controller.py cat > src/controllers/experiment_controller.py << 'EOF' from ..models.experiment_model import ExperimentModel class ExperimentController: def __init__(self, view): self.model = ExperimentModel() self.view = view def update_model_from_view(self): factors = self.view.get_factors_data() self.model.set_factors(factors) responses = [] for row in range(self.view.responses_table.rowCount()): name_item = self.view.responses_table.item(row, 0) unit_item = self.view.responses_table.item(row, 1) if name_item: responses.append({ 'name': name_item.text(), 'unit': unit_item.text() if unit_item else "" }) self.model.set_responses(responses) self.model.set_center_points(self.view.center_points_spin.value()) self.model.set_randomize(self.view.randomize_check.isChecked()) EOF # Файл: main.py cat > main.py << 'EOF' import sys import os sys.path.insert(0, os.path.join(os.path.dirname(__file__), 'src')) from PyQt5.QtWidgets import QApplication from src.views import MainWindow def main(): app = QApplication(sys.argv) app.setStyle('Fusion') assistant = MainWindow() assistant.show() sys.exit(app.exec_()) if __name__ == "__main__": main() EOF # Файл: run.sh cat > run.sh << 'EOF' #!/bin/bash python3 main.py EOF chmod +x run.sh # Файл: requirements.txt cat > requirements.txt << 'EOF' PyQt5>=5.15.0 numpy>=1.19.0 EOF echo -e "${GREEN}========================================${NC}" echo -e "${GREEN}Реорганизация завершена!${NC}" echo -e "${GREEN}========================================${NC}" echo -e "${YELLOW}Для запуска обновлённой версии:${NC}" echo -e "${GREEN}python3 main.py${NC}" echo "" echo -e "${GREEN}или${NC}" echo -e "${GREEN}./run.sh${NC}" echo "" echo -e "${YELLOW}Бэкап старых файлов:${NC} $BACKUP_DIR"