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Effect of Polymer Additives on the Crystal Habit of Metformin HCl
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Novel Computational Approach to Guide Impurities Rejection by Crystallization: A Case Study of MRTX849 Impurities
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Uncertainty Distribution of Crystal Structure Prediction
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Selecting a Stable Solid Form of Remdesivir Using Microcrystal Electron Diffraction and Crystal Structure Prediction
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Polymorphism of Piroxicam: New Polymorphs by Melt Crystallization and Crystal Structure Prediction
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Rich Polymorphism in nicotinamide revealed by melt crystallization and crystal structure prediction
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Virtual Coformer Screening by Crystal Structure Predictions: Crucial Role of Crystallinity in Pharmaceutical Cocrystallization
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Computational Prediction of Mutational Effects on SARS-CoV-2 Binding by Relative Free Energy Calculations
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Prediction of the Relative Free Energies of Drug Polymorphs Above Zero Kelvin
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Computational Insights into Kinetic Hindrance Affecting Crystallization of Stable Forms of Active Pharmaceutical Ingredients
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Overcoming the difficulties of predicting conformational polymorph energetics in molecular crystals via correlated wavefunction methods
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Solid-Form Transition Temperature Prediction from a Virtual Polymorph Screening: A Reality Check
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Solubility of paracetamol in ethanol by molecular dynamics using the extended Einstein crystal method and experiments
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Harnessing Cloud Architecture for Crystal Structure Prediction Calculations
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