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Application

Discovery Studio 1.0 Materials Studio 0.46937901498929335 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04657293497363796 Amorphous Cell 0.18804920913884007 Blends 0.0 CASTEP 0.2680140597539543 CDOCKER 0.37785588752196836 CHARMm 0.45342706502636204 COMPASS 0.2820738137082601 COMPASS III 0.070298769771529 COSMObase 0.0 COSMOperm 0.0 COSMOquick 0.0017574692442882249 COSMOtherm 0.03954305799648506 Catalyst 0.2451669595782074 Classical Simulations 1.0 Crystallization 0.05008787346221441 DMol3 0.13181019332161686 DPD 8.787346221441124E-4 Discover 8.787346221441124E-4 Forcite 0.3945518453427065 GULP 0.006151142355008787 LUDI 0.009666080843585237 LibDock 0.13268892794376097 LigandFit 0.009666080843585237 MCSS 8.787346221441124E-4 MODELER 0.4156414762741652 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.0026362038664323375 Morphology 0.008787346221441126 ONETEP 0.0 Polymorph 0.0035149384885764497 QSAR 0.0 Quantum Mechanics 0.3945518453427065 Reflex 0.03690685413005272 Reflex Plus 0.0 Sorption 0.021968365553602813 Visualization 0.953427065026362 X-Cell 0.0 ZDOCK 0.03602811950790861

Year

2023 0.07992998833138856 2024 0.676196032672112 2025 1.0 2026 0.3290548424737456 2027 0.0

Keywords

novel 1.0 target 0.9455345060893099 potential 0.37922868741542626 docking 0.32374830852503383 analysis 0.18098782138024358 visualization 0.16001353179972935 promising 0.13802435723951287 synthesized 0.12550744248985116 activity 0.10216508795669824 binding 0.09675236806495263 development 0.09066305818673884 synthesis 0.08998646820027063 between 0.06867388362652233 compound 0.06393775372124492 therapeutic 0.03349120433017591 protein 0.018944519621109608 effective 0.018606224627875506 vitro 0.017591339648173207 drug 0.010487144790257105 stability 0.010487144790257105 design 0.007780784844384303 inhibition 0.005751014884979702 cell 0.004397834912043302 potent 0.0037212449255751017 including 0.0
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