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Commits on Feb 26, 2026

• Merge pull request #344 from LYT-academic/master

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• Update Dockerfile to resolve cmake problem

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Commits on Dec 23, 2025

• deepdock edits

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Commits on Nov 30, 2025

• deepdockign script

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Commits on Nov 3, 2025

• cuda13 fixes

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Commits on Aug 11, 2025

• Initial pygnina work

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Commits on Jul 8, 2025

• update build instructions (cudnn)

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Commits on Jun 19, 2025

• Fix for Issue #327

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Commits on May 23, 2025

• README update

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• Documentation updates

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• issue tempalte update

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Commits on Apr 30, 2025

• Limit queue size to reduce mem usage

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Commits on Apr 28, 2025

• build updates

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Commits on Mar 4, 2025

• Fix Boost 1.84 building

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• Boost 1.87 compat

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Commits on Oct 7, 2024

• openbabel vers

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• Add openbabel version requirement

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• Merge branch 'master' of github.com:gnina/gnina

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• tweaks

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Commits on Oct 5, 2024

• Merge pull request #282 from RMeli/cmake2

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• cmake

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Commits on Oct 4, 2024

• Merge pull request #280 from RMeli/jsoncpp

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• jsoncpp include

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• make model notebook

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• update libraries

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• remove required from first torch find_package

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• Updated cmake and readme

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Commits on Sep 23, 2024

• Describe model saving

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Commits on Aug 16, 2024

• Respect --cpu in torch.

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Commits on May 15, 2024

• Update ubuntu 22.04 dockerfile

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Commits on May 7, 2024

• Remove 18.04

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Commits on May 6, 2024

• Better behaved covalent min/scoring

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Commits on May 3, 2024

• refine warning

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• tweak fix

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• Skip the numerical check

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