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學術發表

  • 學術發表
Templated Nucleation of Clotrimazole and Ketoprofen on Polymer Substrates
  • 學術發表
Tale of Two Polymorphs: Investigating the Structural Differences and Dynamic Relationship between Nirmatrelvir Solid Forms (Paxlovid)
  • 學術發表
WUREN: Whole-modal union representation for epitope prediction
  • 學術發表, 小分子藥物發現
Structural insights into drug transport by an aquaglyceroporin
  • 學術發表
Towards the efficient design of shared neoantigen peptide cancer vaccines using artificial intelligence
  • 學術發表, 小分子藥物發現
Application scenario-oriented molecule generation platform developed for drug discovery
  • 學術發表, 小分子藥物發現
Development and Comprehensive Benchmark of a High-Quality AMBER-Consistent Small Molecule Force Field with Broad Chemical Space Coverage for Molecular Modeling and Free Energy Calculation
  • 學術發表, 小分子藥物發現
Hit Identification Driven by Combining Artificial Intelligence and Computational Chemistry Methods: A PI5P4K-β Case Study
  • 學術發表
Cocrystal Synthesis through Crystal Structure Prediction
  • 學術發表
Effect of Polymer Additives on the Crystal Habit of Metformin HCl
  • 學術發表
Absolute Configuration Determination of Chiral API Molecules by MicroED Analysis of Cocrystal Powders Formed Based on Cocrystal Propensity Prediction Calculations
  • 學術發表, 小分子藥物發現
DORN1 and GORK regulate stomatal closure in Arabidopsis mediated by volatile organic compound ethyl vinyl ketone

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