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CANDLE-compliant Python API for Uno_IMPROVE

Status: Open.

#127In ECP-CANDLE/Benchmarks;

· j-woz opened on Mar 15, 2024

Feature to write out history and metadata in CANDLE-standard format

Status: Open.

#115In ECP-CANDLE/Benchmarks;

· j-woz opened on Feb 20, 2023

model_name required

Status: Open.

#114In ECP-CANDLE/Benchmarks;

· rajeeja opened on Jan 12, 2023

Testing: Split Theta tests into plain and Singularity

Status: Open.

#101In ECP-CANDLE/Benchmarks;

· j-woz opened on Apr 20, 2022

Missing parameter causing errors in NT3 (P1B4)

Status: Open.

#99In ECP-CANDLE/Benchmarks;

· vgutta opened on Oct 19, 2021

Generate All.h5 data using uno_baseline_keras2.py

Status: Open.

#97In ECP-CANDLE/Benchmarks;

· zhen-xie opened on Sep 14, 2021

P2B2 tf/keras API

Status: Open.

#92In ECP-CANDLE/Benchmarks;

· rajeeja opened on Jun 16, 2021

Issue running drug example

Status: Open.

#70In ECP-CANDLE/Benchmarks;

· akhilpandey95 opened on Aug 6, 2020

create logging standard

Status: Open.

#52In ECP-CANDLE/Benchmarks;

· rajeeja opened on Nov 13, 2019

Use tensorflow.keras module on Summit

Status: Open.

#51In ECP-CANDLE/Benchmarks;

· j-woz opened on Nov 6, 2019

README for Pilot3

Status: Open.

#47In ECP-CANDLE/Benchmarks;

· rajeeja opened on Sep 18, 2019

save argument does not get overwritten by command line arg

Status: Open.

#41In ECP-CANDLE/Benchmarks;

· brettin opened on Mar 19, 2019