1. Ligand-based and structure-based studies to develop predictive models for SARS-CoV-2 main protease inhibitors through the 3d-qsar.com portal

   • Eleonora Proia
   • Alessio Ragno
   • Rino Ragno

   OriginalPaper Open access 18 June 2022 Pages: 483 - 505

   

2. Identification of HPr kinase/phosphorylase inhibitors: novel antimicrobials against resistant Enterococcus faecalis

   • Sandeep Kumar
   • Rajendra Bhadane
   • Suman Kapila

   OriginalPaper Open access 09 July 2022 Pages: 507 - 520

   

3. In silico identification and in vitro antiviral validation of potential inhibitors against Chikungunya virus

   • Jyoti Verma
   • Abdul Hasan
   • Naidu Subbarao

   OriginalPaper 05 July 2022 Pages: 521 - 536

   

4. On the force field optimisation of \(\beta\)-lactam cores using the force field Toolkit

   • Qiyang Wu
   • Tianyang Huang
   • Ying-Chih Chiang

   OriginalPaper Open access 11 July 2022 Pages: 537 - 547

   

5. Crystal polymorphism and spectroscopical properties of sulfonamides in solid state by means of First Principles calculations

   • C. Ignacio Sainz-Díaz
   • Alexander Pérez de la Luz
   • Catalina Soriano-Correa

   OriginalPaper Open access 26 July 2022 Pages: 549 - 562