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Application

Discovery Studio 0.859023152553124 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06891776736259055 Amorphous Cell 0.2871751171708564 Blends 0.0026629740093736683 CASTEP 0.3981678738815509 CDOCKER 0.1497656582871751 CHARMm 0.2365786109927567 COMPASS 0.37175117170856414 COMPASS III 0.08734554750745632 COSMObase 0.003728163613123136 COSMOconf 0.004473796335747763 COSMOmic 1.0651896037494674E-4 COSMOperm 0.0012782275244993609 COSMOplex 2.1303792074989347E-4 COSMOquick 0.0014912654452492544 COSMOtherm 0.06476352790796762 Cantera 0.0 Catalyst 0.10449510012782275 Classical Simulations 1.0 Conformers 7.456327226246272E-4 Crystallization 0.07552194290583723 DFTB Plus 0.006071580741371964 DMol3 0.1782062207072859 DPD 0.002876011930123562 Discover 0.0035151256923732425 Forcite 0.552087771623349 GULP 0.023753728163613125 Kinetix 2.1303792074989347E-4 LUDI 0.003302087771623349 LibDock 0.06252662974009374 LigandFit 0.004260758414997869 MCSS 4.2607584149978694E-4 MODELER 0.18992330634853005 MesoDyn 9.586706433745207E-4 Mesocite 0.003621644652748189 Mesoscale 0.006817213463996591 Modules 0.0 Morphology 0.01821474222411589 ONETEP 0.0010651896037494673 Polymorph 0.002023860247123988 QMERA 2.1303792074989347E-4 QSAR 0.001171708564124414 Quantum Mechanics 0.5654026416702173 Reflex 0.054644226672347675 Reflex Plus 9.586706433745207E-4 Semi-empirical 0.007882403067746058 Sorption 0.05752023860247124 Synthia 0.0014912654452492544 TURBOMOLE 5.325948018747337E-4 VAMP 0.0013847464848743077 Visualization 0.7362590541116318 X-Cell 0.0013847464848743077 ZDOCK 0.025244993608862377

Year

2022 0.0051427558077673345 2023 0.2506650115268665 2024 0.6087072175917716 2025 1.0 2026 0.37683986522433055 2027 0.0

Keywords

target 1.0 potential 0.2783384525376627 docking 0.1967237092291941 analysis 0.19067817268782605 visualization 0.17561308566135245 between 0.15664765247915752 novel 0.09648481302715615 energy 0.09624104139242358 cell 0.06591585003169032 promising 0.06201550387596899 binding 0.06147920627955731 activity 0.04363512261713227 performance 0.03944225049973185 stability 0.03885719857637365 experimental 0.031154014918824045 interaction 0.027692457705621374 synthesized 0.025449758666081616 effective 0.019891765394178734 mechanism 0.01808785529715762 including 0.016673979815708645 development 0.01647896250792258 synthesis 0.00516795865633075 protein 0.004290380771293453 design 4.8754326946516503E-4 enhanced 0.0
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