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Application

Discovery Studio 0.9516250944822373 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.048109965635738834 Amorphous Cell 0.2809278350515464 Blends 0.001718213058419244 CASTEP 0.24312714776632302 CDOCKER 0.16065292096219932 CHARMm 0.24656357388316152 COMPASS 0.33075601374570446 COMPASS III 0.1323024054982818 COSMObase 0.001718213058419244 COSMOconf 0.009450171821305841 COSMOmic 0.0 COSMOperm 8.59106529209622E-4 COSMOplex 0.0 COSMOtherm 0.061855670103092786 Catalyst 0.07560137457044673 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08247422680412371 DFTB Plus 0.002577319587628866 DMol3 0.11254295532646048 DPD 0.001718213058419244 Discover 0.002577319587628866 Forcite 0.5438144329896907 GULP 0.00859106529209622 Kinetix 0.0 LUDI 0.0 LibDock 0.06099656357388316 LigandFit 0.002577319587628866 MODELER 0.22938144329896906 Mesocite 0.00429553264604811 Mesoscale 0.006013745704467354 Morphology 0.020618556701030927 ONETEP 0.001718213058419244 Polymorph 8.59106529209622E-4 Quantum Mechanics 0.3548109965635739 Reflex 0.05756013745704467 Reflex Plus 0.0 Semi-empirical 0.002577319587628866 Sorption 0.06701030927835051 Synthia 8.59106529209622E-4 TURBOMOLE 0.0 Visualization 0.6245704467353952 ZDOCK 0.023195876288659795

Year

2025 0.9061643835616439 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.30241018644838563 docking 0.21964529331514324 analysis 0.20964074579354253 visualization 0.153706230104593 between 0.13142337426102774 promising 0.09731696225557071 novel 0.08867667121418826 binding 0.07639836289222374 cell 0.07503410641200546 energy 0.06321055025011368 activity 0.05638926784902228 performance 0.045929968167348796 stability 0.045929968167348796 strategy 0.03819918144611187 strong 0.03638017280582083 including 0.02819463392451114 therapeutic 0.027285129604365622 development 0.022282855843565257 enhanced 0.022282855843565257 mechanism 0.022282855843565257 synthesized 0.021828103683492497 effective 0.020463847203274217 design 0.010459299681673489 interaction 0.0
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