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music-shops Public
Places to buy plugins, WAVs, loops, VST instruments and more
Mozilla Public License 2.0 UpdatedAug 27, 2024 -
ConPLex Public
Forked from samsledje/ConPLexAdapting protein language models and contrastive learning for highly-accurate drug-target interaction prediction.
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covid19-SARS-CoV-2 Public
Covid-19 (SARS-CoV-2) coronavirus
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QCxMS Public
Forked from qcxms/QCxMSQuantum mechanic mass spectrometry calculation program
Fortran GNU Lesser General Public License v3.0 UpdatedAug 13, 2021 -
quantum-xtb Public
Benchmarks and examples for Grimme's semiempirical GFNn-xTB
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pfp-sar Public
Structure–activity relationship analysis for the pentafluorophenyl library
HTML Creative Commons Zero v1.0 Universal UpdatedSep 23, 2020 -
cloud-computing Public
A resource that discusses Azure, AWS and Google cloud and cluster computing
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Virtual-Screening-files Public
Forked from Bioinformatics-Review/Virtual-Screening-filesPerl UpdatedApr 10, 2020 -
VFVS Public
Forked from VirtualFlow/VFVSVirtualFlow for Virtual Screening
Shell GNU General Public License v3.0 UpdatedMar 29, 2020 -
VFTools Public
Forked from VirtualFlow/VFToolsShell GNU General Public License v3.0 UpdatedMar 23, 2020 -
orca-linux-deployment Public
Forked from lijikun/orca-linux-deploymentScripts and instructions for deploying ORCA quantum chemistry program on Linux.
Shell UpdatedMar 5, 2020 -
xtb Public
Forked from grimme-lab/xtbSemiempirical Extended Tight-Binding Program Package
Fortran GNU Lesser General Public License v3.0 UpdatedFeb 26, 2020 -
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VFLP Public
Forked from VirtualFlow/VFLPVirtualFlow for Ligand Preparation
Shell GNU General Public License v3.0 UpdatedNov 17, 2019 -
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deep-molecular-massspec Public
Forked from brain-research/deep-molecular-massspecMass Spectrometry for Small Molecules using Deep Learning
Python Apache License 2.0 UpdatedAug 30, 2019 -
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NAMD-xtb-QMMM-interface Public
Forked from fhh2626/NAMD-xtb-QMMM-interfaceNAMD-xtb-QMMM-interface
Python UpdatedMar 18, 2019 -
prosit Public
Forked from kusterlab/prositProteomeTools Spectrum predIction Tool
Python Apache License 2.0 UpdatedMar 5, 2019 -
Collision-induced dissociation (CID) in mass spectrometry
1 UpdatedMar 4, 2019 -
forcebalance Public
Forked from leeping/forcebalanceSystematic force field optimization.
Python Other UpdatedJan 9, 2019 -
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LightGBM Public
Forked from microsoft/LightGBMA fast, distributed, high performance gradient boosting (GBDT, GBRT, GBM or MART) framework based on decision tree algorithms, used for ranking, classification and many other machine learning tasks…
C++ MIT License UpdatedSep 4, 2018 -
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keras_swish_beta Public
Forked from ChingChuan-Chen/keras_swish_betaKeras with Swish Beta Activation Function
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A-Primer-on-Using-the-Bioinformatics-Core-Administrated-Servers-and-Cluster-s- Public
Forked from ucdavis-bioinformatics-training/A-Primer-on-Using-the-Bioinformatics-Core-Administrated-Servers-a...A Primer on Using the Bioinformatics Core Administrated Servers and Cluster(s)
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caret-machine-learning Public
Practical examples for the R caret machine learning package
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xyz-scripts Public
Forked from jaapkroe/xyz-scriptscollection of bash/AWK scripts for processing xyz coordinate files
Python UpdatedMar 9, 2016
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