API for road2stat/Rcpi
Molecular Informatics Toolkit for Compound-Protein Interaction in Drug Discovery
| Global functions | |
|---|---|
| .calcSeqPairSim | Source code |
| .calcgoPairSim | Source code |
| AA2DACOR | Man page |
| AA3DMoRSE | Man page |
| AAACF | Man page |
| AABLOSUM100 | Man page |
| AABLOSUM45 | Man page |
| AABLOSUM50 | Man page |
| AABLOSUM62 | Man page |
| AABLOSUM80 | Man page |
| AABurden | Man page |
| AACPSA | Man page |
| AAConn | Man page |
| AAConst | Man page |
| AADescAll | Man page |
| AAEdgeAdj | Man page |
| AAEigIdx | Man page |
| AAFGC | Man page |
| AAGETAWAY | Man page |
| AAGeom | Man page |
| AAInfo | Man page |
| AAMOE2D | Man page |
| AAMOE3D | Man page |
| AAMetaInfo | Man page |
| AAMolProp | Man page |
| AAPAM120 | Man page |
| AAPAM250 | Man page |
| AAPAM30 | Man page |
| AAPAM40 | Man page |
| AAPAM70 | Man page |
| AARDF | Man page |
| AARandic | Man page |
| AATopo | Man page |
| AATopoChg | Man page |
| AAWHIM | Man page |
| AAWalk | Man page |
| AAindex | Man page |
| OptAA3d | Man page |
| Rcpi | Man page |
| Rcpi-package | Man page |
| acc | Man page |
| calcDrugFPSim | Man page Source code |
| calcDrugMCSSim | Man page Source code |
| calcParProtGOSim | Man page Source code |
| calcParProtSeqSim | Man page Source code |
| calcTwoProtGOSim | Man page Source code |
| calcTwoProtSeqSim | Man page Source code |
| checkProt | Man page |
| check_ob | Source code |
| convMolFormat | Man page |
| evaluateDescriptor | Source code |
| extractDrugAIO | Man page |
| extractDrugALOGP | Man page |
| extractDrugAminoAcidCount | Man page |
| extractDrugApol | Man page |
| extractDrugAromaticAtomsCount | Man page |
| extractDrugAromaticBondsCount | Man page |
| extractDrugAtomCount | Man page |
| extractDrugAutocorrelationCharge | Man page |
| extractDrugAutocorrelationMass | Man page |
| extractDrugAutocorrelationPolarizability | Man page |
| extractDrugBCUT | Man page |
| extractDrugBPol | Man page |
| extractDrugBondCount | Man page |
| extractDrugCPSA | Man page |
| extractDrugCarbonTypes | Man page |
| extractDrugChiChain | Man page |
| extractDrugChiCluster | Man page |
| extractDrugChiPath | Man page |
| extractDrugChiPathCluster | Man page |
| extractDrugDescOB | Man page |
| extractDrugECI | Man page |
| extractDrugEstate | Man page |
| extractDrugEstateComplete | Man page |
| extractDrugExtended | Man page Source code |
| extractDrugExtendedComplete | Man page Source code |
| extractDrugFMF | Man page |
| extractDrugFragmentComplexity | Man page |
| extractDrugGraph | Man page Source code |
| extractDrugGraphComplete | Man page Source code |
| extractDrugGravitationalIndex | Man page |
| extractDrugHBondAcceptorCount | Man page |
| extractDrugHBondDonorCount | Man page |
| extractDrugHybridization | Man page Source code |
| extractDrugHybridizationComplete | Man page Source code |
| extractDrugHybridizationRatio | Man page |
| extractDrugIPMolecularLearning | Man page |
| extractDrugKR | Man page |
| extractDrugKRComplete | Man page |
| extractDrugKappaShapeIndices | Man page |
| extractDrugKierHallSmarts | Man page |
| extractDrugLargestChain | Man page |
| extractDrugLargestPiSystem | Man page |
| extractDrugLengthOverBreadth | Man page |
| extractDrugLongestAliphaticChain | Man page |
| extractDrugMACCS | Man page |
| extractDrugMACCSComplete | Man page |
| extractDrugMDE | Man page |
| extractDrugMannholdLogP | Man page |
| extractDrugMomentOfInertia | Man page |
| extractDrugOBFP2 | Man page |
| extractDrugOBFP3 | Man page |
| extractDrugOBFP4 | Man page |
| extractDrugOBMACCS | Man page |
| extractDrugPetitjeanNumber | Man page |
| extractDrugPetitjeanShapeIndex | Man page |
| extractDrugPubChem | Man page |
| extractDrugPubChemComplete | Man page |
| extractDrugRotatableBondsCount | Man page |
| extractDrugRuleOfFive | Man page |
| extractDrugShortestPath | Man page Source code |
| extractDrugShortestPathComplete | Man page Source code |
| extractDrugStandard | Man page Source code |
| extractDrugStandardComplete | Man page Source code |
| extractDrugTPSA | Man page |
| extractDrugVABC | Man page |
| extractDrugVAdjMa | Man page |
| extractDrugWHIM | Man page |
| extractDrugWeight | Man page |
| extractDrugWeightedPath | Man page |
| extractDrugWienerNumbers | Man page |
| extractDrugXLogP | Man page |
| extractDrugZagrebIndex | Man page |
| extractPCMBLOSUM | Man page |
| extractPCMDescScales | Man page |
| extractPCMFAScales | Man page |
| extractPCMMDSScales | Man page |
| extractPCMPropScales | Man page |
| extractPCMScales | Man page |
| extractProtAAC | Man page |
| extractProtAPAAC | Man page |
| extractProtCTDC | Man page |
| extractProtCTDD | Man page |
| extractProtCTDT | Man page |
| extractProtCTriad | Man page |
| extractProtDC | Man page |
| extractProtGeary | Man page |
| extractProtMoran | Man page |
| extractProtMoreauBroto | Man page |
| extractProtPAAC | Man page |
| extractProtPSSM | Man page Source code |
| extractProtPSSMAcc | Man page Source code |
| extractProtPSSMFeature | Man page Source code |
| extractProtQSO | Man page |
| extractProtSOCN | Man page |
| extractProtTC | Man page |
| getCPI | Man page |
| getDrug | Man page Source code |
| getFASTAFromKEGG | Man page |
| getFASTAFromUniProt | Man page |
| getFingerprint | Source code |
| getMolFromCAS | Man page |
| getMolFromChEMBL | Man page |
| getMolFromDrugBank | Man page |
| getMolFromKEGG | Man page |
| getMolFromPubChem | Man page |
| getPDBFromRCSBPDB | Man page |
| getPPI | Man page Source code |
| getProt | Man page Source code |
| getSeqFromKEGG | Man page |
| getSeqFromRCSBPDB | Man page |
| getSeqFromUniProt | Man page |
| getSmiFromChEMBL | Man page |
| getSmiFromDrugBank | Man page |
| getSmiFromKEGG | Man page |
| getSmiFromPubChem | Man page |
| getSmiles | Source code |
| get_pwa | Source code |
| get_url_parallel | Source code |
| is_pkg_available | Source code |
| is_pwalign_installed | Source code |
| is_pwalign_needed | Source code |
| loadMolecules | Source code |
| parseSmiles | Source code |
| readFASTA | Man page |
| readMolFromSDF | Man page |
| readMolFromSmi | Man page |
| readPDB | Man page Source code |
| resolve_pwa | Source code |
| searchDrug | Man page Source code |
| segProt | Man page |
