Beran, G.

Authored

(600b) Can Density Functional Theory Provide Insights into the Solid-State Photochemical Degradation of Pharmaceuticals?
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(606b) Identifying and Addressing the Weaknesses of Density Functional Theory for Crystal Structure Prediction
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(524a) Advances in Crystal Structure Prediction for Conformationally Flexible Molecules
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(231b) A Simple Fix Addresses Severe Density Functional Theory Polymorph Ranking Problems in Pharmaceuticals
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)

Related Proceedings

2020 Virtual AIChE Annual Meeting2021 Annual Meeting2022 Annual Meeting2023 AIChE Annual Meeting