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Application

Discovery Studio 0.8500931098696461 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057757644394110984 Amorphous Cell 0.2904869762174405 Blends 0.0016987542468856172 CASTEP 0.29388448471121176 CDOCKER 0.15005662514156284 CHARMm 0.2304643261608154 COMPASS 0.3527746319365798 COMPASS III 0.12287655719139298 COSMObase 0.003963759909399773 COSMOconf 0.007927519818799546 COSMOmic 0.0 COSMOperm 5.662514156285391E-4 COSMOplex 5.662514156285391E-4 COSMOtherm 0.06625141562853908 Catalyst 0.06681766704416761 Classical Simulations 1.0 Conformers 5.662514156285391E-4 Crystallization 0.08097395243488109 DFTB Plus 0.0022650056625141564 DMol3 0.13023782559456398 DPD 0.0016987542468856172 Discover 0.003963759909399773 Forcite 0.5532276330690826 GULP 0.01245753114382786 Kinetix 0.0 LUDI 0.0011325028312570782 LibDock 0.06058890147225368 LigandFit 0.0022650056625141564 MODELER 0.21630804077010193 Mesocite 0.005096262740656852 Mesoscale 0.00622876557191393 Morphology 0.01812004530011325 ONETEP 0.0011325028312570782 Polymorph 0.0016987542468856172 Quantum Mechanics 0.42072480181200456 Reflex 0.059456398640996604 Reflex Plus 0.0 Semi-empirical 0.0033975084937712344 Sorption 0.06172140430351076 Synthia 0.0011325028312570782 TURBOMOLE 0.0 VAMP 5.662514156285391E-4 Visualization 0.6245753114382786 X-Cell 5.662514156285391E-4 ZDOCK 0.02491506228765572

Year

2025 0.8124213176668066 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3084848484848485 analysis 0.21515151515151515 docking 0.2006060606060606 visualization 0.15787878787878787 between 0.13666666666666666 promising 0.09757575757575758 novel 0.08818181818181818 energy 0.0796969696969697 cell 0.07696969696969697 binding 0.06848484848484848 performance 0.06787878787878789 activity 0.05 stability 0.04878787878787879 strong 0.040606060606060604 strategy 0.03787878787878788 enhanced 0.029393939393939392 mechanism 0.02909090909090909 including 0.02878787878787879 effective 0.02181818181818182 development 0.02090909090909091 design 0.011212121212121211 synthesized 0.011212121212121211 experimental 0.005151515151515152 therapeutic 0.0
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