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Application

Discovery Studio 1.0 Materials Studio 0.8843329253365974 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05836680053547524 Amorphous Cell 0.26586345381526105 Blends 0.0024096385542168677 CASTEP 0.3030789825970549 CDOCKER 0.18473895582329317 CHARMm 0.29611780455153947 COMPASS 0.32663989290495316 COMPASS III 0.10361445783132531 COSMObase 0.004819277108433735 COSMOconf 0.0050870147255689425 COSMOmic 0.0 COSMOperm 5.35475234270415E-4 COSMOplex 2.677376171352075E-4 COSMOquick 8.032128514056225E-4 COSMOtherm 0.06265060240963856 Catalyst 0.08326639892904954 Classical Simulations 1.0 Conformers 5.35475234270415E-4 Crystallization 0.07228915662650602 DFTB Plus 0.00321285140562249 DMol3 0.14404283801874163 DPD 0.0029451137884872825 Discover 0.00428380187416332 Forcite 0.5046854082998661 GULP 0.015528781793842034 Kinetix 2.677376171352075E-4 LUDI 0.00428380187416332 LibDock 0.07550200803212852 LigandFit 0.004016064257028112 MODELER 0.2744310575635877 MesoDyn 0.0 Mesocite 0.0034805890227576973 Mesoscale 0.006157965194109772 Modules 0.0 Morphology 0.01606425702811245 ONETEP 0.00107095046854083 Polymorph 0.0024096385542168677 QMERA 2.677376171352075E-4 QSAR 5.35475234270415E-4 Quantum Mechanics 0.4393574297188755 Reflex 0.05220883534136546 Reflex Plus 8.032128514056225E-4 Semi-empirical 0.00428380187416332 Sorption 0.05461847389558233 Synthia 8.032128514056225E-4 TURBOMOLE 0.0 VAMP 2.677376171352075E-4 Visualization 0.7376171352074966 X-Cell 0.001606425702811245 ZDOCK 0.030522088353413655

Year

2024 0.3482720178372352 2025 1.0 2026 0.8680044593088071 2027 0.0

Keywords

target 1.0 potential 0.32460870708930684 docking 0.2485860844403525 analysis 0.23201367881099566 visualization 0.1771669077995528 between 0.13665658292779165 novel 0.0946994607391819 promising 0.09259502827831119 binding 0.08680783901091674 energy 0.058266473760357755 cell 0.05642509535709588 activity 0.05484677101144285 stability 0.03906352755491253 performance 0.0265684598184927 including 0.021833486781533604 effective 0.01749309483098777 strong 0.016835459686965672 synthesized 0.015783243456530316 development 0.013941865053268446 mechanism 0.008286202814678416 enhanced 0.006839405497829804 protein 0.00565566223859003 interaction 0.004866500065763515 experimental 7.891621728265158E-4 therapeutic 0.0
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