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Our ‘proof-of-principle’ development work on in silico design of safer pesticides was published in Science Advances:
Our method for adopting strategies from computational drug discovery to aid in designing safer chemicals was featured on the cover of RSC Green Chemistry:
Historical snippets from the development of our in silico safer chemical design approaches
Our early efforts in this area were recognized in Nature:
Our subsequent design work in collaboration with the MoDRM team were highlighted in Science:
Conference recordings:
ACS GC&E 2021: Systems-Thinking Approach to Computational Design of Safer Pesticides