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Application

Discovery Studio 1.0 Materials Studio 0.9006404992609623 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059736898857019625 Amorphous Cell 0.2745309467328014 Blends 0.0019409100711667026 CASTEP 0.3234850118611171 CDOCKER 0.18330817338796634 CHARMm 0.29264610739702396 COMPASS 0.32262238516282077 COMPASS III 0.10696571058874273 COSMObase 0.004313133491481561 COSMOconf 0.00668535691179642 COSMOmic 0.0 COSMOperm 4.3131334914815614E-4 COSMOplex 2.1565667457407807E-4 COSMOquick 0.0012939400474444684 COSMOtherm 0.0659909424196679 Catalyst 0.0875566098770757 Classical Simulations 1.0 Conformers 4.3131334914815614E-4 Crystallization 0.07051973258572353 DFTB Plus 0.0038818201423334053 DMol3 0.14707785205952123 DPD 0.0023722234203148586 Discover 0.003450506793185249 Forcite 0.5098123786931206 GULP 0.018762130687944793 Kinetix 2.1565667457407807E-4 LUDI 0.004313133491481561 LibDock 0.07720508949751995 LigandFit 0.004528790166055639 MCSS 4.3131334914815614E-4 MODELER 0.2704334699158939 MesoDyn 6.469700237222342E-4 Mesocite 0.0023722234203148586 Mesoscale 0.005175760189777874 Modules 0.0 Morphology 0.016389907267629934 ONETEP 8.626266982963123E-4 Polymorph 0.0015095967220185465 QMERA 0.0 QSAR 6.469700237222342E-4 Quantum Mechanics 0.4617209402631011 Reflex 0.05132628854863058 Reflex Plus 6.469700237222342E-4 Semi-empirical 0.005607073538926029 Sorption 0.05585507871468622 Synthia 0.0012939400474444684 TURBOMOLE 0.0 VAMP 0.0012939400474444684 Visualization 0.7422902738839767 X-Cell 0.0015095967220185465 ZDOCK 0.03256415786068579

Year

2023 0.0 2024 0.4734441186054089 2025 1.0 2026 0.5679374389051809 2027 0.001466275659824047

Keywords

target 1.0 potential 0.2849422288483041 docking 0.214498695490123 analysis 0.19474468878121506 visualization 0.15579575102497203 between 0.12793514722325755 novel 0.08879985091315691 promising 0.0743570629891912 binding 0.07212076034289974 energy 0.059914275065225495 cell 0.05143496086470369 activity 0.047335072679836006 stability 0.030469623555721206 performance 0.02236302646291465 including 0.018263138278046962 development 0.013231457323891166 synthesized 0.012206485277674246 effective 0.010156541185240403 mechanism 0.008386134923592994 protein 0.006895266492732016 interaction 0.005683935892657473 experimental 0.004845322400298174 strong 0.0010249720462169214 enhanced 6.522549385016772E-4 synthesis 0.0
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