DFT calculations, molecular docking and SAR investigation for the formation of eutectic mixture using thiourea and salicylic acid
Anirudh Pratap Singh Raman, Madhur Babu Singh, Mansi Chaudhary, Indra Bahdur, Pallavi Jain, Neha Kaushik, Neha Kaushik, Eun Ha Choi, Nagendra Kumar Kaushik, Nagendra Kumar Kaushik, Aditya Aryan Lal, Prashant Singh
Topics & Concepts
Eutectic systemThioureaBinding energyMoleculeDensity functional theoryThermodynamicsChemistryMaterials sciencePhysical chemistryComputational chemistryOrganic chemistryPhysicsAtomic physicsAlloyIonic liquids properties and applicationsPhase Equilibria and ThermodynamicsChemical and Physical Properties in Aqueous Solutions