diff --git a/docs/conf.py b/docs/conf.py index 6630ce3e..888d5742 100644 --- a/docs/conf.py +++ b/docs/conf.py @@ -20,7 +20,7 @@ project = "gmso" copyright = "2024, mosdef-hub, Vanderbilt University" -author = "Matt Thompson, Alex Yang, Ray Matsumoto, Parashara Shamaprasad, Umesh Timalsina, Co D. Quach, Ryan S. DeFever, Justin Gilmer" +author = "Matt Thompson, Alex Yang, Ray Matsumoto, Parashara Shamaprasad, Umesh Timalsina, Co D. Quach, Ryan S. DeFever, Justin Gilmer, Nicholas C. Craven, Christopher R. Iacovella, Brad Crawford, and Chris Jones" # The full version, including alpha/beta/rc tags version = "0.12.4" diff --git a/gmso/utils/equation_compare.py b/gmso/utils/equation_compare.py index 9bc050d8..b96edd0f 100644 --- a/gmso/utils/equation_compare.py +++ b/gmso/utils/equation_compare.py @@ -483,7 +483,8 @@ def evaluate_OPLS_torsion_format_with_scaler(new_torsion_form, base_torsion_form values = sympy.nonlinsolve( [ eqn_ratio - - sympy.sympify(new_torsion_form) / sympy.sympify(base_torsion_form), + - sympy.nsimplify(new_torsion_form) + / sympy.nsimplify(base_torsion_form), ], [eqn_ratio], )