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Application

Discovery Studio 1.0 Materials Studio 0.567759900990099 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06326304106548279 Amorphous Cell 0.2297447280799112 Blends 0.0 CASTEP 0.2902330743618202 CDOCKER 0.24639289678135406 CHARMm 0.3973362930077691 COMPASS 0.29245283018867924 COMPASS III 0.06881243063263041 COSMObase 0.0022197558268590455 COSMOconf 0.006104328523862375 COSMOperm 0.0 COSMOquick 0.0022197558268590455 COSMOtherm 0.05382907880133185 Catalyst 0.11376248612652608 Classical Simulations 1.0 Crystallization 0.05493895671476138 DFTB Plus 0.003329633740288568 DMol3 0.12153163152053274 DPD 0.0011098779134295228 Discover 0.0022197558268590455 Forcite 0.4406215316315205 GULP 0.01609322974472808 LUDI 0.004994450610432853 LibDock 0.10377358490566038 LigandFit 0.004994450610432853 MODELER 0.38568257491675917 MesoDyn 0.001664816870144284 Mesocite 0.0022197558268590455 Mesoscale 0.005549389567147614 Morphology 0.013318534961154272 QSAR 0.0011098779134295228 Quantum Mechanics 0.4039955604883463 Reflex 0.04051054384017758 Semi-empirical 0.004439511653718091 Sorption 0.03607103218645949 Synthia 0.0 TURBOMOLE 0.0 VAMP 5.549389567147614E-4 Visualization 0.935072142064373 X-Cell 0.001664816870144284 ZDOCK 0.04273029966703663

Year

2025 0.0

Keywords

target 1.0 potential 0.36659831396673503 docking 0.3016632490316701 analysis 0.22966507177033493 visualization 0.19799498746867167 between 0.12257917521075416 binding 0.11711095921622237 novel 0.1089086352244247 promising 0.09273182957393483 activity 0.07496012759170653 including 0.034859876965140126 therapeutic 0.03349282296650718 cell 0.028708133971291867 stability 0.027796764638869903 protein 0.02688539530644794 development 0.018910913647755753 interaction 0.01822738664843928 strong 0.015493278651173389 energy 0.012075643654591022 silico 0.007518796992481203 effective 0.002734107997265892 synthesis 0.002050580997949419 synthesized 0.001367053998632946 vitro 0.001139211665527455 inhibition 0.0
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