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. 2020 Feb 25;8(4):e1166. doi: 10.1002/mgg3.1166

Table 1.

In silico tools and databases used in the present study

Tool URL Input
PolyPhen‐2 (investigation of variants) http://genetics.bwh.harvard.edu/pph2 Sequence
PopMusic (ΔΔG) http://dezyme.com Uploaded 3D structure
DUET (ΔΔG) http://biosig.unimelb.edu.au/duet Uploaded 3D structure
MaestroWeb (ΔΔG) https://biwww.che.sbg.ac.at/maestro/web Uploaded 3D structure
SAAFEC (ΔΔG) http://compbio.clemson.edu/SAAFEC Uploaded 3D structure
Missense3D http://www.sbg.bio.ic.ac.uk/~missense3d Protein sequence or 3D structure/PDB ID
VarSite https://www.ebi.ac.uk/thornton-srv/databases/VarSite UniProt ID, or search terms or disease
FlexPred (flexibility prediction) http://kiharalab.org/flexPred Uploaded 3D structure
PredyFlexy (flexibility prediction) http://www.dsimb.inserm.fr/dsimb_tools/predyflexy Sequence
Clustal Omega (multiple sequence alignment) https://www.ebi.ac.uk/Tools/msa Sequence
meta‐PPISP (prediction of PPI sites) http://pipe.scs.fsu.edu/meta-ppisp Uploaded 3D structure
FTMap (binding pocket prediction) http://ftmap.bu.edu/home.php Uploaded 3D structure
ClusPro (macromolecular docking) https://cluspro.org Uploaded 3D structure
PPM (protein membrane interaction prediction) http://opm.phar.umich.edu Uploaded 3D structure
pyDockWeb (macromolecular docking) https://life.bsc.es/pid/pydock Uploaded 3D structure
RING‐2.0 (residue interaction network) http://protein.bio.unipd.it/ring Uploaded 3D structure
Cytoscape (data visualization) http://www.cytoscape.org RING output XLM file
ChannelsDB (investigate channels) https://webchemdev.ncbr.muni.cz/ChannelsDB PDB ID
PharmVar (variation database) https://www.pharmvar.org/htdocs/archive/index_original.htm
gnomAD (Genome Aggregation Database) https://gnomad.broadinstitute.org/
ClinVar (genomic variation database) https://www.ncbi.nlm.nih.gov/clinvar/
Chimera (molecular graphics) http://www.cgl.ucsf.edu/chimera
PyMol (molecular graphics) http://www.pymol.org
PDB (protein structure database) https://www.rcsb.org
UniProt (annotated protein database) http://www.uniprot.org