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Application

Discovery Studio 1.0 Materials Studio 0.9156275976724855 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06219839142091153 Amorphous Cell 0.27265415549597855 Blends 0.0018766756032171583 CASTEP 0.31983914209115283 CDOCKER 0.17372654155495978 CHARMm 0.2831099195710456 COMPASS 0.33351206434316355 COMPASS III 0.10053619302949061 COSMObase 0.004021447721179625 COSMOconf 0.006970509383378016 COSMOmic 0.0 COSMOperm 5.361930294906167E-4 COSMOplex 2.6809651474530834E-4 COSMOquick 8.042895442359249E-4 COSMOtherm 0.064343163538874 Catalyst 0.08873994638069706 Classical Simulations 1.0 Conformers 2.6809651474530834E-4 Crystallization 0.06890080428954423 DFTB Plus 0.002680965147453083 DMol3 0.14316353887399463 DPD 0.0010723860589812334 Discover 0.004021447721179625 Forcite 0.5150134048257373 GULP 0.018230563002680965 Kinetix 0.0 LUDI 0.004289544235924933 LibDock 0.0772117962466488 LigandFit 0.0037533512064343165 MCSS 8.042895442359249E-4 MODELER 0.27292225201072384 MesoDyn 8.042895442359249E-4 Mesocite 0.0032171581769436996 Mesoscale 0.005093833780160858 Morphology 0.016353887399463807 ONETEP 5.361930294906167E-4 Polymorph 0.0013404825737265416 QMERA 0.0 QSAR 5.361930294906167E-4 Quantum Mechanics 0.4544235924932976 Reflex 0.05013404825737265 Reflex Plus 0.0 Semi-empirical 0.004021447721179625 Sorption 0.05201072386058981 Synthia 8.042895442359249E-4 TURBOMOLE 2.6809651474530834E-4 VAMP 8.042895442359249E-4 Visualization 0.7351206434316354 X-Cell 0.0018766756032171583 ZDOCK 0.032975871313672925

Year

2023 0.0012373685295937306 2024 0.3765724891730254 2025 1.0 2026 0.6698288306867395 2027 0.0

Keywords

target 1.0 potential 0.3154490106544901 docking 0.23503297818366312 analysis 0.2176560121765601 visualization 0.17300862506341957 between 0.1419330289193303 novel 0.09969558599695585 promising 0.0837138508371385 binding 0.08295281582952815 energy 0.06506849315068493 cell 0.0578386605783866 activity 0.053018772196854386 stability 0.03919330289193303 performance 0.026382546930492135 including 0.025748351090816843 effective 0.016235413495687467 development 0.01610857432775241 mechanism 0.013952308472856417 strong 0.01293759512937595 interaction 0.012430238457635717 synthesized 0.011161846778285134 protein 0.010781329274479959 experimental 0.006722475900558092 enhanced 0.006595636732623034 therapeutic 0.0
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