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Application

Discovery Studio 0.7961699093409392 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06589830508474576 Amorphous Cell 0.2936949152542373 Blends 0.0023050847457627118 CASTEP 0.3818305084745763 CDOCKER 0.14020338983050848 CHARMm 0.22833898305084746 COMPASS 0.3690847457627119 COMPASS III 0.09708474576271187 COSMObase 0.004203389830508475 COSMOconf 0.005423728813559322 COSMOmic 1.3559322033898305E-4 COSMOperm 0.0013559322033898306 COSMOplex 1.3559322033898305E-4 COSMOquick 0.0014915254237288136 COSMOtherm 0.06752542372881357 Cantera 0.0 Catalyst 0.08067796610169492 Classical Simulations 1.0 Conformers 5.423728813559322E-4 Crystallization 0.07322033898305084 DFTB Plus 0.005288135593220339 DMol3 0.17220338983050848 DPD 0.0023050847457627118 Discover 0.003661016949152542 Forcite 0.5609491525423729 GULP 0.021152542372881358 Kinetix 2.711864406779661E-4 LUDI 0.00311864406779661 LibDock 0.06074576271186441 LigandFit 0.003389830508474576 MCSS 4.0677966101694915E-4 MODELER 0.2120677966101695 MesoDyn 8.135593220338983E-4 Mesocite 0.002983050847457627 Mesoscale 0.005830508474576271 Modules 0.0 Morphology 0.01735593220338983 ONETEP 0.0010847457627118644 Polymorph 0.002033898305084746 QMERA 1.3559322033898305E-4 QSAR 9.491525423728814E-4 Quantum Mechanics 0.5429152542372881 Reflex 0.05288135593220339 Reflex Plus 0.0012203389830508474 Semi-empirical 0.006779661016949152 Sorption 0.059118644067796614 Synthia 0.0013559322033898306 TURBOMOLE 4.0677966101694915E-4 VAMP 0.0010847457627118644 Visualization 0.6585762711864407 X-Cell 0.0014915254237288136 ZDOCK 0.02440677966101695

Year

2023 0.04577153521265102 2024 0.4172478145565269 2025 1.0 2026 0.4174442589136627 2027 0.0

Keywords

target 1.0 potential 0.2830384341175708 analysis 0.19761488106811848 docking 0.18309676583057877 between 0.16222697517661547 visualization 0.15282908808088663 energy 0.1019508717350444 novel 0.09495106617408776 promising 0.07472940566465747 cell 0.07181282001425886 binding 0.057489143820079074 performance 0.05379480199624084 stability 0.04465616695832523 activity 0.03862855661416813 experimental 0.030980620908678463 including 0.02424006740553503 effective 0.022619742044202477 synthesized 0.022360489986389266 interaction 0.02074016462505671 mechanism 0.01950871735044397 development 0.016981009786765183 enhanced 0.015490310454339231 design 0.004536911011731155 strong 0.0025925205781320887 synthesis 0.0
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