An End-to-End Framework for Molecular Conformation Generation
              via Bilevel Programming

                Minkai Xu 1 2 Wujie Wang 3 Shitong Luo 4 Chence Shi 1 2
                Yoshua Bengio 1 2 5 Rafael Gomez-Bombarelli 3 Jian Tang 1 5 6

              Abstract                  though this is empirically effective, in reality molecules are
                                    better represented as 3D structures (also known as confor-
   Predicting molecular conformations (or 3D struc ...