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Application

Discovery Studio 1.0 Materials Studio 0.8310679611650486 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04050632911392405 Amorphous Cell 0.2518987341772152 Blends 0.0 CASTEP 0.23417721518987342 CDOCKER 0.18860759493670887 CHARMm 0.29240506329113924 COMPASS 0.32531645569620254 COMPASS III 0.10886075949367088 COSMObase 0.0012658227848101266 COSMOconf 0.010126582278481013 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0012658227848101266 COSMOtherm 0.06455696202531645 Catalyst 0.0949367088607595 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08227848101265822 DFTB Plus 0.0037974683544303796 DMol3 0.12278481012658228 Discover 0.0 Forcite 0.5151898734177215 GULP 0.01139240506329114 Kinetix 0.0 LUDI 0.002531645569620253 LibDock 0.08481012658227848 LigandFit 0.0037974683544303796 MODELER 0.2810126582278481 Mesocite 0.002531645569620253 Mesoscale 0.002531645569620253 Morphology 0.020253164556962026 ONETEP 0.0012658227848101266 Polymorph 0.0012658227848101266 Quantum Mechanics 0.3569620253164557 Reflex 0.056962025316455694 Semi-empirical 0.0037974683544303796 Sorption 0.06329113924050633 Synthia 0.0012658227848101266 Visualization 0.7075949367088608 X-Cell 0.0 ZDOCK 0.030379746835443037

Year

2025 1.0 2026 0.8827906976744186 2027 0.0

Keywords

target 1.0 potential 0.3374922021210231 docking 0.24079850280723644 analysis 0.2152214597629445 visualization 0.1671865252651279 between 0.12164691203992514 novel 0.10792264504054896 promising 0.0941983780411728 binding 0.07860262008733625 cell 0.056768558951965066 activity 0.046787273861509666 energy 0.044915782907049284 including 0.041172800998128506 stability 0.040548970679975045 therapeutic 0.035558328134747345 strategy 0.03056768558951965 development 0.029320024953212728 strong 0.024329382407985028 performance 0.021834061135371178 mechanism 0.015595757953836557 synthesized 0.014348097317529632 effective 0.011228945726762321 synthesis 0.006238303181534623 protein 0.004366812227074236 design 0.0
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