From 70ba9a21204bcdcb085a02f9a33370d3bfe512bc Mon Sep 17 00:00:00 2001 From: Kobi Felton Date: Fri, 19 Feb 2021 00:36:08 +0000 Subject: [PATCH] Bump version to 0.8.0rc0 (#90) --- pyproject.toml | 5 ++--- summit/benchmarks/MIT/MIT_kin_case1.py | 2 +- summit/benchmarks/MIT/MIT_kin_case2.py | 2 +- summit/benchmarks/MIT/MIT_kin_case3.py | 2 +- summit/benchmarks/MIT/MIT_kin_case4.py | 2 +- summit/benchmarks/MIT/MIT_kin_case5.py | 2 +- 6 files changed, 7 insertions(+), 8 deletions(-) diff --git a/pyproject.toml b/pyproject.toml index 7efb4cb7..55f30989 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -1,13 +1,13 @@ [tool.poetry] name = "summit" -version = "0.6.0" +version = "0.8.0rc0" description = "Tools for optimizing chemical processes" authors = ["Kobi Felton ", "Jan Rittig"] license = "MIT" readme = 'README.md' repository = "https://github.com/sustainable-processes/summit" homepage = "https://github.com/sustainable-processes/summit" -keywords = ["machine-learning", "chemistry", "reactions", "optimization", "neural-networks", "process optimization", "bayesian-optimization", "nelder-mead", "snobfit", "gryffin", "TSEMO"] +keywords = ["machine-learning", "chemistry", "bayesian-reaction-optimization", "reaction-optimization", "neural-networks", "process optimization", "bayesian-optimization", "nelder-mead", "snobfit", "gryffin", "TSEMO"] [tool.poetry.dependencies] # Core dependencies @@ -32,7 +32,6 @@ pymoo = "^0.4.1" SQSnobFit = "^0.4.3" # Dependencies for MTBO - botorch = "*" # Temporary fix https://github.com/pytorch/botorch/issues/668 gpytorch = "1.3.0" diff --git a/summit/benchmarks/MIT/MIT_kin_case1.py b/summit/benchmarks/MIT/MIT_kin_case1.py index 61630c22..f13c071a 100644 --- a/summit/benchmarks/MIT/MIT_kin_case1.py +++ b/summit/benchmarks/MIT/MIT_kin_case1.py @@ -167,4 +167,4 @@ def _integrand(self, t, C, cat_index, T): def to_dict(self, **kwargs): experiment_params = dict(noise_level=self.noise_level) - return super().to_dict(**experiment_params) \ No newline at end of file + return super().to_dict(**experiment_params) diff --git a/summit/benchmarks/MIT/MIT_kin_case2.py b/summit/benchmarks/MIT/MIT_kin_case2.py index cf2e049f..450218c6 100644 --- a/summit/benchmarks/MIT/MIT_kin_case2.py +++ b/summit/benchmarks/MIT/MIT_kin_case2.py @@ -166,4 +166,4 @@ def _integrand(self, t, C, cat_index, T): def to_dict(self, **kwargs): experiment_params = dict(noise_level=self.noise_level) - return super().to_dict(**experiment_params) \ No newline at end of file + return super().to_dict(**experiment_params) diff --git a/summit/benchmarks/MIT/MIT_kin_case3.py b/summit/benchmarks/MIT/MIT_kin_case3.py index 3d752f5a..8cfee5d0 100644 --- a/summit/benchmarks/MIT/MIT_kin_case3.py +++ b/summit/benchmarks/MIT/MIT_kin_case3.py @@ -166,4 +166,4 @@ def _integrand(self, t, C, cat_index, T): def to_dict(self, **kwargs): experiment_params = dict(noise_level=self.noise_level) - return super().to_dict(**experiment_params) \ No newline at end of file + return super().to_dict(**experiment_params) diff --git a/summit/benchmarks/MIT/MIT_kin_case4.py b/summit/benchmarks/MIT/MIT_kin_case4.py index a638a8c0..38356df3 100644 --- a/summit/benchmarks/MIT/MIT_kin_case4.py +++ b/summit/benchmarks/MIT/MIT_kin_case4.py @@ -167,4 +167,4 @@ def _integrand(self, t, C, cat_index, T): def to_dict(self, **kwargs): experiment_params = dict(noise_level=self.noise_level) - return super().to_dict(**experiment_params) \ No newline at end of file + return super().to_dict(**experiment_params) diff --git a/summit/benchmarks/MIT/MIT_kin_case5.py b/summit/benchmarks/MIT/MIT_kin_case5.py index 30380fde..69310e12 100644 --- a/summit/benchmarks/MIT/MIT_kin_case5.py +++ b/summit/benchmarks/MIT/MIT_kin_case5.py @@ -171,4 +171,4 @@ def _integrand(self, t, C, cat_index, T): def to_dict(self, **kwargs): experiment_params = dict(noise_level=self.noise_level) - return super().to_dict(**experiment_params) \ No newline at end of file + return super().to_dict(**experiment_params)