Jas Kalayan

According to our database, Jas Kalayan authored at least 3 papers between 2021 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2024

Molecular dynamics simulations as a guide for modulating small molecule aggregation.

Azam Nesabi, Jas Kalayan, Sara Al Rawashdeh, Mohammad A. Ghattas, Richard A. Bryce

J. Comput. Aided Mol. Des., December, 2024

2021

Energy-entropy prediction of octanol-water logP of SAMPL7 N-acyl sulfonamide bioisosters.

Fabio Falcioni, Jas Kalayan, Richard H. Henchman

J. Comput. Aided Mol. Des., 2021

Energy-entropy method using multiscale cell correlation to calculate binding free energies in the SAMPL8 host-guest challenge.

Hafiz Saqib Ali, Arghya Chakravorty, Jas Kalayan, Sam P. de Visser, Richard H. Henchman

J. Comput. Aided Mol. Des., 2021