Integrated use of ligand and structure-based virtual screening, molecular dynamics, free energy calculation and ADME prediction for the identification of potential PTP1B inhibitors
Titel:
Integrated use of ligand and structure-based virtual screening, molecular dynamics, free energy calculation and ADME prediction for the identification of potential PTP1B inhibitors
Auteur:
Devi, Bharti Vasishta, Sumukh Satyanarayana Das, Bhanuranjan Baidya, Anurag T. K. Rampa, Rahul Salmon Mahapatra, Manoj Kumar Kumar, Rajnish