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Application

Discovery Studio 0.6768982229402262 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.056818181818181816 Amorphous Cell 0.29545454545454547 Blends 0.002066115702479339 CASTEP 0.32644628099173556 CDOCKER 0.12706611570247933 CHARMm 0.20041322314049587 COMPASS 0.3584710743801653 COMPASS III 0.13739669421487602 COSMObase 0.004132231404958678 COSMOconf 0.008264462809917356 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.07334710743801653 Catalyst 0.056818181818181816 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07644628099173553 DFTB Plus 0.0 DMol3 0.1384297520661157 DPD 0.0 Discover 0.0 Forcite 0.5702479338842975 GULP 0.012396694214876033 LUDI 0.0 LibDock 0.049586776859504134 LigandFit 0.002066115702479339 MODELER 0.17355371900826447 Mesocite 0.006198347107438017 Mesoscale 0.007231404958677686 Morphology 0.01652892561983471 ONETEP 0.0010330578512396695 Polymorph 0.0 Quantum Mechanics 0.46384297520661155 Reflex 0.05785123966942149 Semi-empirical 0.0010330578512396695 Sorption 0.05785123966942149 Synthia 0.0010330578512396695 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.5464876033057852 ZDOCK 0.01859504132231405

Year

2025 0.65465032444124 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.27917888563049853 analysis 0.19530791788856305 docking 0.15425219941348975 between 0.1536656891495601 visualization 0.12668621700879765 promising 0.093841642228739 energy 0.09325513196480939 cell 0.08504398826979472 performance 0.08035190615835777 novel 0.07272727272727272 stability 0.04985337243401759 enhanced 0.04398826979472141 strategy 0.03929618768328446 strong 0.03812316715542522 activity 0.0281524926686217 binding 0.0281524926686217 including 0.025219941348973606 effective 0.021114369501466276 design 0.01994134897360704 mechanism 0.016422287390029325 development 0.015835777126099706 experimental 0.00469208211143695 synthesized 0.004105571847507331 stable 0.0
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