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Application

Discovery Studio 0.9538834951456311 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04768211920529802 Amorphous Cell 0.280794701986755 Blends 0.0013245033112582781 CASTEP 0.21589403973509932 CDOCKER 0.15496688741721854 CHARMm 0.2304635761589404 COMPASS 0.3483443708609272 COMPASS III 0.12450331125827814 COSMObase 0.0026490066225165563 COSMOconf 0.010596026490066225 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.07417218543046358 Catalyst 0.07417218543046358 Classical Simulations 1.0 Crystallization 0.07549668874172186 DFTB Plus 0.0013245033112582781 DMol3 0.0913907284768212 DPD 0.0026490066225165563 Discover 0.003973509933774834 Forcite 0.5483443708609271 GULP 0.007947019867549669 Kinetix 0.0 LibDock 0.060927152317880796 LigandFit 0.0 MODELER 0.2251655629139073 Mesocite 0.0026490066225165563 Mesoscale 0.005298013245033113 Morphology 0.015894039735099338 ONETEP 0.0026490066225165563 Polymorph 0.0 Quantum Mechanics 0.3072847682119205 Reflex 0.054304635761589407 Semi-empirical 0.0013245033112582781 Sorption 0.06357615894039735 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.614569536423841 ZDOCK 0.018543046357615896

Year

2025 0.9016216216216216 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.2872191011235955 analysis 0.20646067415730338 docking 0.20435393258426968 visualization 0.14185393258426968 between 0.11235955056179775 novel 0.08426966292134831 promising 0.08286516853932584 binding 0.07092696629213484 cell 0.06671348314606741 energy 0.046348314606741575 performance 0.042134831460674156 activity 0.04073033707865169 strong 0.027387640449438203 synthesized 0.027387640449438203 strategy 0.02457865168539326 stability 0.023876404494382022 therapeutic 0.023174157303370788 mechanism 0.014747191011235955 including 0.012640449438202247 design 0.011235955056179775 effective 0.008426966292134831 enhanced 0.0049157303370786515 development 0.0035112359550561797 synthesis 0.0
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