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Hotfix in API bugs & Update examples #41

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Merged
merged 4 commits into from
Jun 17, 2022
Merged

Hotfix in API bugs & Update examples #41

merged 4 commits into from
Jun 17, 2022

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@Ericwang6
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@Ericwang6 Ericwang6 commented Jun 16, 2022

  1. Add judging None in parseElement to avoid bugs in parsing protein force fields
  2. Remove modifying pairs in calculate LJ to avoid mismatch of dimensions
  3. Fix bugs in parsing multiple files, caused by jax parameter too early
  4. Update examples

@KuangYu KuangYu merged commit f2e1859 into deepmodeling:devel Jun 17, 2022
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@KuangYu KuangYu KuangYu approved these changes

@Roy-Kid Roy-Kid Awaiting requested review from Roy-Kid

@WangXinyan940 WangXinyan940 Awaiting requested review from WangXinyan940

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@Ericwang6 @KuangYu