TY - RPRT TI - A line integral reaction path approximation for large systems via nonlinear constrained optimization: application to alanine dipeptide and the beta hairpin of protein G. AU - Ilja V Khavrutskii AU - Richard H Byrd AU - Charles L Brooks PY - 2006 DO - 10.1063/1.2194544 UR - https://pubmed.ncbi.nlm.nih.gov/16729840/ ID - 16729840 ER -