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Application

Discovery Studio 1.0 Materials Studio 0.8651389932381668 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04891041162227603 Amorphous Cell 0.26440677966101694 Blends 9.685230024213075E-4 CASTEP 0.2682808716707022 CDOCKER 0.18595641646489103 CHARMm 0.29491525423728815 COMPASS 0.32832929782082326 COMPASS III 0.11573849878934625 COSMObase 0.00387409200968523 COSMOconf 0.007263922518159807 COSMOmic 0.0 COSMOperm 4.8426150121065375E-4 COSMOplex 4.8426150121065375E-4 COSMOtherm 0.061501210653753025 Catalyst 0.08135593220338982 Classical Simulations 1.0 Conformers 4.8426150121065375E-4 Crystallization 0.07215496368038742 DFTB Plus 0.003389830508474576 DMol3 0.1234866828087167 DPD 0.0014527845036319612 Discover 0.003389830508474576 Forcite 0.5050847457627119 GULP 0.01162227602905569 Kinetix 0.0 LUDI 0.002421307506053269 LibDock 0.07651331719128329 LigandFit 0.00387409200968523 MODELER 0.2692493946731235 Mesocite 0.00387409200968523 Mesoscale 0.004842615012106538 Morphology 0.01646489104116223 ONETEP 9.685230024213075E-4 Polymorph 0.001937046004842615 Quantum Mechanics 0.38789346246973366 Reflex 0.05230024213075061 Reflex Plus 0.0 Semi-empirical 0.00387409200968523 Sorption 0.059564164648910414 Synthia 9.685230024213075E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7196125907990315 X-Cell 4.8426150121065375E-4 ZDOCK 0.03292978208232446

Year

2024 0.0 2025 1.0 2026 0.9211752060193479 2027 0.0035829451809387316

Keywords

target 1.0 potential 0.33349657198824684 docking 0.24853085210577866 analysis 0.2257590597453477 visualization 0.17654260528893242 between 0.12365328109696376 promising 0.09720861900097943 novel 0.09280117531831537 binding 0.08570029382957885 activity 0.059745347698334964 energy 0.05754162585700294 cell 0.053623898139079335 stability 0.039177277179236046 strong 0.03330068560235064 performance 0.030362389813907934 including 0.029627815866797257 development 0.01860920666013712 therapeutic 0.016405484818805095 effective 0.012242899118511263 mechanism 0.011753183153770812 strategy 0.010039177277179236 enhanced 0.007835455435847209 synthesized 0.007835455435847209 protein 0.0012242899118511264 interaction 0.0
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