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Application

Discovery Studio 0.5552721088435374 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0546218487394958 Amorphous Cell 0.30357142857142855 Blends 0.0021008403361344537 CASTEP 0.25630252100840334 CDOCKER 0.10609243697478991 CHARMm 0.15861344537815125 COMPASS 0.37184873949579833 COMPASS III 0.14180672268907563 COSMObase 0.0021008403361344537 COSMOconf 0.011554621848739496 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.0703781512605042 Catalyst 0.051470588235294115 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08508403361344538 DFTB Plus 0.0021008403361344537 DMol3 0.11764705882352941 DPD 0.0021008403361344537 Discover 0.0031512605042016808 Forcite 0.6029411764705882 GULP 0.009453781512605041 Kinetix 0.0 LibDock 0.03991596638655462 LigandFit 0.0010504201680672268 MODELER 0.14390756302521007 Mesocite 0.005252100840336135 Mesoscale 0.007352941176470588 Morphology 0.01995798319327731 ONETEP 0.0021008403361344537 Polymorph 0.0010504201680672268 Quantum Mechanics 0.37289915966386555 Reflex 0.059873949579831935 Semi-empirical 0.0021008403361344537 Sorption 0.07142857142857142 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.44642857142857145 ZDOCK 0.01680672268907563

Year

2025 0.5464313123561013 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.23450479233226837 analysis 0.1731629392971246 between 0.136741214057508 docking 0.12332268370607029 energy 0.0939297124600639 performance 0.09329073482428114 cell 0.08690095846645367 visualization 0.08434504792332269 promising 0.07284345047923323 novel 0.05750798722044728 strategy 0.051118210862619806 stability 0.03769968051118211 strong 0.024920127795527155 binding 0.022364217252396165 enhanced 0.021086261980830672 synthesized 0.021086261980830672 design 0.017252396166134186 experimental 0.017252396166134186 mechanism 0.017252396166134186 activity 0.016613418530351438 effective 0.01597444089456869 amorphous 0.005111821086261981 including 6.389776357827476E-4 efficient 0.0
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