Alpeshkumar K Malde

Effect of Binding on Enantioselectivity of Epoxide Hydrolase

Mikael Bodén, Julian Zaugg, Alan E Mark, 2018, J. Chem. Inf. Model..

Missing fragments: detecting cooperative binding in fragment-based drug design.

Alan E Mark, Alpeshkumar K Malde, Pramod C. Nair, 2012, ACS medicinal chemistry letters.

Automated Topology Builder Version 3.0: Prediction of Solvation Free Enthalpies in Water and Hexane.

Bertrand Caron, Alan E Mark, Alpeshkumar K Malde, 2018, Journal of chemical theory and computation.

Pharmacophore modeling in drug discovery and development: an overview.

Santosh A. Khedkar, Alpeshkumar K Malde, Sudha Srivastava, 2007, Medicinal chemistry (Shariqah (United Arab Emirates)).

Using Theory to Reconcile Experiment: The Structural and Thermodynamic Basis of Ligand Recognition by Phenylethanolamine N-Methyltransferase (PNMT).

Alan E Mark, Alpeshkumar K Malde, Pramod C. Nair, 2011, Journal of chemical theory and computation.

Binding and enantiomeric selectivity of threonyl-tRNA synthetase.

Alan E Mark, Alpeshkumar K Malde, A. Mark, 2009, Journal of the American Chemical Society.