Using computational chemistry to create 'designer molecules' for industry. ScienceDaily . Retrieved June 3, 2025 from www.sciencedaily.com / releases / 2010 / 04 / 100401131101.htm ...

Crunch numbers to the nth degree — and see what happens. When you study computer science and mathematics, you’ll use algorithms and computational theory to create mathematical models or define ...

Dynamic programming (DP) algorithms have become indispensable in computational biology, addressing problems that range from sequence alignment and phylogenetic inference to RNA secondary structure ...

Thakkar’s group has compared training datasets for the types of predictive synthesis algorithms Coley works on and found they performed well no matter what data they were trained on (Chem. Sci ...