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Application

Discovery Studio 1.0 Materials Studio 0.7105263157894737 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.047080979284369114 Amorphous Cell 0.2523540489642185 Blends 0.0018832391713747645 CASTEP 0.23163841807909605 CDOCKER 0.20903954802259886 CHARMm 0.3314500941619586 COMPASS 0.2937853107344633 COMPASS III 0.11958568738229755 COSMObase 0.002824858757062147 COSMOconf 0.007532956685499058 COSMOmic 0.0 COSMOperm 9.416195856873823E-4 COSMOtherm 0.06120527306967985 Catalyst 0.08851224105461393 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06779661016949153 DFTB Plus 0.0018832391713747645 DMol3 0.1016949152542373 DPD 0.002824858757062147 Discover 0.003766478342749529 Forcite 0.4849340866290019 GULP 0.007532956685499058 Kinetix 0.0 LUDI 0.0 LibDock 0.0800376647834275 LigandFit 0.002824858757062147 MODELER 0.2862523540489642 Mesocite 0.003766478342749529 Mesoscale 0.005649717514124294 Morphology 0.014124293785310734 ONETEP 0.0018832391713747645 Polymorph 0.0018832391713747645 Quantum Mechanics 0.3314500941619586 Reflex 0.0480225988700565 Reflex Plus 0.0 Semi-empirical 0.0018832391713747645 Sorption 0.059322033898305086 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.795668549905838 ZDOCK 0.03389830508474576

Year

2025 1.0 2026 0.7644078530715643 2027 0.0

Keywords

target 1.0 potential 0.30492898913951544 docking 0.2552213868003342 analysis 0.20509607351712614 visualization 0.18045112781954886 binding 0.1035923141186299 between 0.09523809523809523 promising 0.08563074352548036 novel 0.08437761069340016 activity 0.06850459482038429 therapeutic 0.04302422723475355 cell 0.04093567251461988 including 0.03258145363408521 strong 0.030492898913951544 stability 0.02631578947368421 energy 0.023809523809523808 development 0.012531328320802004 mechanism 0.012531328320802004 effective 0.00835421888053467 protein 0.006683375104427736 strategy 0.006683375104427736 synthesized 0.005847953216374269 performance 0.004177109440267335 inhibition 4.177109440267335E-4 synthesis 0.0
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